PMID-sentid Pub_year Sent_text comp_official_name comp_offsetprotein_name organism prot_offset 21853970-0 2011 Tuning of the spin distribution between ligand- and metal-based spin: electron paramagnetic resonance of mixed-ligand molybdenum tris(dithiolene) complex anions. Metals 52-57 spindlin 1 Homo sapiens 14-18 21971505-0 2011 Spin coupling and relaxation inside molecule-metal contacts. Metals 45-50 spindlin 1 Homo sapiens 0-4 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 29-34 spindlin 1 Homo sapiens 123-127 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 29-34 spindlin 1 Homo sapiens 151-155 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 29-34 spindlin 1 Homo sapiens 151-155 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 58-63 spindlin 1 Homo sapiens 123-127 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 58-63 spindlin 1 Homo sapiens 151-155 21971505-2 2011 Here we show that bonding of metal-organic complexes to a metallic substrate induces the formation of coupled metal-ligand spin states, increasing the spin degeneracy of the molecules and opening multiple spin relaxation channels. Metals 58-63 spindlin 1 Homo sapiens 151-155 26598250-1 2011 Spin-flip time-dependent density functional theory (SF-TDDFT) has been applied to predict magnetic coupling constants for a database of 12 spin-1/2 homobinuclear transition-metal complexes previously studied by Phillips and Peralta employing spin-projected broken-symmetry density functional theory (Phillips, J. J.; Peralta, J. E. J. Chem. Metals 173-178 spindlin 1 Homo sapiens 0-4 26598250-1 2011 Spin-flip time-dependent density functional theory (SF-TDDFT) has been applied to predict magnetic coupling constants for a database of 12 spin-1/2 homobinuclear transition-metal complexes previously studied by Phillips and Peralta employing spin-projected broken-symmetry density functional theory (Phillips, J. J.; Peralta, J. E. J. Chem. Metals 173-178 spindlin 1 Homo sapiens 139-143 26598250-1 2011 Spin-flip time-dependent density functional theory (SF-TDDFT) has been applied to predict magnetic coupling constants for a database of 12 spin-1/2 homobinuclear transition-metal complexes previously studied by Phillips and Peralta employing spin-projected broken-symmetry density functional theory (Phillips, J. J.; Peralta, J. E. J. Chem. Metals 173-178 spindlin 1 Homo sapiens 242-246 21952523-5 2011 It is also shown that, when a normal metal is sandwiched in between two superconductors, both spin current and transverse mode-resolved spin density are only residing at two interfaces due to the smearing effect of the multimode transport. Metals 37-42 spindlin 1 Homo sapiens 94-98 21952523-5 2011 It is also shown that, when a normal metal is sandwiched in between two superconductors, both spin current and transverse mode-resolved spin density are only residing at two interfaces due to the smearing effect of the multimode transport. Metals 37-42 spindlin 1 Homo sapiens 136-140 21902237-3 2011 Here we demonstrate that surface plasmon polariton waves propagating along the interface between a metal and a dielectric layer can be used to detect the spin-state changes in the latter with high sensitivity, even at the nanometer scale. Metals 99-104 spindlin 1 Homo sapiens 154-158 21739970-1 2011 Spin polarized de-excitation of a metastable helium atom interacting with metal surfaces is treated within density functional theory. Metals 74-79 spindlin 1 Homo sapiens 0-4 21739970-3 2011 On the high work function Ag(100) and Ag(111) surfaces, the helium 2s electron is delocalized in the metal and hence the transition rate is weakly spin dependent. Metals 101-106 spindlin 1 Homo sapiens 147-151 21853970-0 2011 Tuning of the spin distribution between ligand- and metal-based spin: electron paramagnetic resonance of mixed-ligand molybdenum tris(dithiolene) complex anions. Metals 52-57 spindlin 1 Homo sapiens 64-68 21853970-2 2011 The mixed complexes fall in between, and the metal character of the spin increases with the bdt content. Metals 45-50 spindlin 1 Homo sapiens 68-72 26596447-2 2011 We have introduced a new method for the calculation of spin-exchange between weakly interacting electron spins on different metal centers. Metals 124-129 spindlin 1 Homo sapiens 55-59 21568607-0 2011 Spin Bose-metal and valence bond solid phases in a spin-1/2 model with ring exchanges on a four-leg triangular ladder. Metals 10-15 spindlin 1 Homo sapiens 51-57 21437303-5 2011 Spin density distribution results show the spin densities for Ti(n)Bz(m)- and Co(n)Bz(m)- (n <= 2, m <= 3) reside mainly on the metal Ti and Co centers (70%-90%). Metals 134-139 spindlin 1 Homo sapiens 0-4 21437303-5 2011 Spin density distribution results show the spin densities for Ti(n)Bz(m)- and Co(n)Bz(m)- (n <= 2, m <= 3) reside mainly on the metal Ti and Co centers (70%-90%). Metals 134-139 spindlin 1 Homo sapiens 43-47 26615927-0 2010 Approximate Multiconfigurational Treatment of Spin-Coupled Metal Complexes. Metals 59-64 spindlin 1 Homo sapiens 46-50 21386600-2 2010 Effects of the thickness of normal metal and a misorientation between the gap vector of the superconductors on the spin and charge currents are investigated. Metals 35-40 spindlin 1 Homo sapiens 115-119 20867997-1 2010 We derive diffusion equations, which describe spin-charge coupled transport on the helical metal surface of a three-dimensional topological insulator. Metals 91-96 spindlin 1 Homo sapiens 46-50 20867997-3 2010 In particular, we predict a new magnetoresistance effect, which manifests in a non-Ohmic correction to a voltage drop between a ferromagnetic spin-polarized electrode and a nonmagnetic electrode, placed on top of the helical metal. Metals 225-230 spindlin 1 Homo sapiens 142-146 20601943-0 2010 Long spin-relaxation time in a single metal nanoparticle. Metals 38-43 spindlin 1 Homo sapiens 5-9 20867880-2 2010 Interestingly, the metal ion as well as the organic ligand show a significant spin dependence of tunneling current flow. Metals 19-24 spindlin 1 Homo sapiens 78-82 21230803-0 2010 Ferroelectricity induced by spin-dependent metal-ligand hybridization in Ba2CoGe2O7. Metals 43-48 spindlin 1 Homo sapiens 28-32 21230803-2 2010 While the ferroelectric polarization cannot be explained by the well-accepted spin current model nor the exchange striction mechanism, we have shown that it is induced by the spin-dependent p-d hybridization between the transition metal (Co) and ligand (O) via the spin-orbit interaction. Metals 231-236 spindlin 1 Homo sapiens 175-179 21230803-2 2010 While the ferroelectric polarization cannot be explained by the well-accepted spin current model nor the exchange striction mechanism, we have shown that it is induced by the spin-dependent p-d hybridization between the transition metal (Co) and ligand (O) via the spin-orbit interaction. Metals 231-236 spindlin 1 Homo sapiens 175-179 26615927-1 2010 The weak interaction between unpaired electrons in polynuclear transition-metal complexes is often described by exchange and spin polarization mechanisms. Metals 74-79 spindlin 1 Homo sapiens 125-129 26615927-8 2010 The proposed configuration interaction schemes may be used to resolve space and spin symmetries in the calculation of electronic structures, exchange coupling constants, and other properties pertinent to polynuclear transition-metal complexes. Metals 227-232 spindlin 1 Homo sapiens 80-84 20366115-0 2009 Spin-orbit qubits of rare-earth-metal ions in axially symmetric crystal fields. Metals 32-37 spindlin 1 Homo sapiens 0-4 20867136-0 2010 Tailoring the spin functionality of a hybrid metal-organic interface by means of alkali-metal doping. Metals 45-50 spindlin 1 Homo sapiens 14-18 20867136-1 2010 We employ a recently developed purpose-made technique based on spin-resolved two-photon photoemission spectroscopy to study the influence of alkali-metal doping (Cs and Na) on the spin functionality of the interface between a cobalt thin film and the organic semiconductor copper phthalocyanine. Metals 148-153 spindlin 1 Homo sapiens 180-184 20867136-3 2010 First, alkali-metal atoms act as impurities and increase the spin-flip probability for the electrons crossing the interface (detrimental effect). Metals 14-19 spindlin 1 Homo sapiens 61-65 20867136-5 2010 We show that the intrinsic effect dominates over the detrimental one, opening the possibility to actively tailor the spin functionality of the considered hybrid metal-organic interface by changing the doping concentration. Metals 161-166 spindlin 1 Homo sapiens 117-121 20010828-2 2010 Spin-polarized tunnelling, successful in ferromagnetic metal junctions, was recently used to inject and detect electron spins in organics and bulk GaAs or Si. Metals 55-60 spindlin 1 Homo sapiens 0-4 20366115-1 2009 Contrary to the well-known spin qubits, rare-earth-metal qubits are characterized by a strong influence of crystal field due to large spin-orbit coupling. Metals 51-56 spindlin 1 Homo sapiens 134-138 19697914-1 2009 Despite their importance in many chemical processes, the relative energies of spin states of transition metal complexes have so far been haunted by large computational errors. Metals 104-109 spindlin 1 Homo sapiens 78-82 19697914-8 2009 We recommend this functional as current state-of-the-art for studying spin crossover and relative energies of close-lying electronic configurations in first-row transition metal systems. Metals 172-177 spindlin 1 Homo sapiens 70-74 19639146-1 2009 Spin-echo detection at 95 GHz enables an electron-paramagnetic-resonance study of a cobalt complex with a bio-mimetic coordination of the transition metal by four sulfur atoms. Metals 149-154 spindlin 1 Homo sapiens 0-4 19588993-1 2009 The 3d orbital ground state of transition-metal ions that are incorporated in a molecular matrix determines the total spin of the transition-metal ion as well as the spin anisotropy and thus the essential magnetic properties of the corresponding molecule. Metals 42-47 spindlin 1 Homo sapiens 118-122 19588993-1 2009 The 3d orbital ground state of transition-metal ions that are incorporated in a molecular matrix determines the total spin of the transition-metal ion as well as the spin anisotropy and thus the essential magnetic properties of the corresponding molecule. Metals 42-47 spindlin 1 Homo sapiens 166-170 19588993-1 2009 The 3d orbital ground state of transition-metal ions that are incorporated in a molecular matrix determines the total spin of the transition-metal ion as well as the spin anisotropy and thus the essential magnetic properties of the corresponding molecule. Metals 141-146 spindlin 1 Homo sapiens 118-122 19588993-4 2009 We demonstrate that polarization-dependent X-ray absorption spectroscopy in combination with a simulation of the spectra is able to shed a brighter light on the spin and orbital ground state of the transition-metal ion in CoPc. Metals 209-214 spindlin 1 Homo sapiens 161-165 19792476-1 2009 A simple expression for the conductance steps in inelastic electron tunneling from spin excitations in a single magnetic atom adsorbed on a nonmagnetic metal surface is derived. Metals 152-157 spindlin 1 Homo sapiens 83-87 19317555-2 2009 Compensated half-metal is found if the spin-orbit coupling is not considered. Metals 17-22 spindlin 1 Homo sapiens 39-43 19317555-3 2009 Spin-orbit coupling induces orbital moments on both Ni and Os, making Sr(2)NiOsO(6) a near compensated half-metal. Metals 108-113 spindlin 1 Homo sapiens 0-4 18775958-6 2008 Measurements of interspin distances via spin-spin relaxation enhancement have the advantages that maximum effects are observed for slower metal relaxation rates than are required for spin-lattice relaxation enhancement, and the impact diminishes as r(-3) instead of r(-6), as with spin-lattice relaxation enhancement, which permits measurements at longer distances. Metals 138-143 spindlin 1 Homo sapiens 21-25 19113734-0 2008 Quantum cavity for spin due to spin-orbit interaction at a metal boundary. Metals 59-64 spindlin 1 Homo sapiens 19-23 19113734-0 2008 Quantum cavity for spin due to spin-orbit interaction at a metal boundary. Metals 59-64 spindlin 1 Homo sapiens 31-35 18775958-6 2008 Measurements of interspin distances via spin-spin relaxation enhancement have the advantages that maximum effects are observed for slower metal relaxation rates than are required for spin-lattice relaxation enhancement, and the impact diminishes as r(-3) instead of r(-6), as with spin-lattice relaxation enhancement, which permits measurements at longer distances. Metals 138-143 spindlin 1 Homo sapiens 40-44 18775958-6 2008 Measurements of interspin distances via spin-spin relaxation enhancement have the advantages that maximum effects are observed for slower metal relaxation rates than are required for spin-lattice relaxation enhancement, and the impact diminishes as r(-3) instead of r(-6), as with spin-lattice relaxation enhancement, which permits measurements at longer distances. Metals 138-143 spindlin 1 Homo sapiens 40-44 18775958-6 2008 Measurements of interspin distances via spin-spin relaxation enhancement have the advantages that maximum effects are observed for slower metal relaxation rates than are required for spin-lattice relaxation enhancement, and the impact diminishes as r(-3) instead of r(-6), as with spin-lattice relaxation enhancement, which permits measurements at longer distances. Metals 138-143 spindlin 1 Homo sapiens 40-44 18588288-1 2008 The S = 11 ground states of the Mn 7 family of mixed-valence complexes with a metal-centered hexagonal topology have been found by density functional theory calculations to arise by spin frustration involving small differences in the magnitudes of the two weakest interactions controlling the alignment of the central spin. Metals 78-83 spindlin 1 Homo sapiens 182-186 21693859-3 2008 The experimental data for 1/T(1) available down to ~1 K are well reproduced by the SCR theory, showing the development of AFM spin fluctuations as the paramagnetic metal approaches a magnetic instability under the applied pressure. Metals 164-169 spindlin 1 Homo sapiens 126-130 16539425-5 2006 To reproduce the available experimental metal hyperfine couplings, the inclusion of spin-orbit effects into the calculations is necessary. Metals 40-45 spindlin 1 Homo sapiens 84-88 21694108-1 2007 A half-metal has been defined as a material with propagating electron states at the Fermi energy only for one of the two possible spin projections, and as such has been promoted as an interesting research direction for spin electronics. Metals 7-12 spindlin 1 Homo sapiens 130-134 21694108-1 2007 A half-metal has been defined as a material with propagating electron states at the Fermi energy only for one of the two possible spin projections, and as such has been promoted as an interesting research direction for spin electronics. Metals 7-12 spindlin 1 Homo sapiens 219-223 17523609-0 2007 Spin-orbit relativistic time-dependent density functional calculations of the metal and ligand pre-edge XAS intensities of organotitanium complexes: TiCl4, Ti(eta5-C5H5)Cl3, and Ti(eta5-C5H5)2Cl2. Metals 78-83 spindlin 1 Homo sapiens 0-4 17455933-0 2007 Electronic structure of a metal-organic copper spin-1/2 molecule: bis(4-cyano-2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II). Metals 26-31 spindlin 1 Homo sapiens 47-53 17455933-1 2007 The metal-organic molecule bis(4-cyano-2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II) (Cu(CNdpm)2) (C24H36N2O4Cu, Cu(II)) is a copper spin-1/2 system with a magnetic moment of 1.05 +/- 0.04 muB/molecule, slightly smaller than the 1.215+/-0.02 muB/molecule for the larger size copper spin-1/2 system C36H48N4O4Cu.C4H8O (bis(4-cyano-2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II) 4,4"-bipyridylethene-THF). Metals 4-9 spindlin 1 Homo sapiens 137-143 17455933-1 2007 The metal-organic molecule bis(4-cyano-2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II) (Cu(CNdpm)2) (C24H36N2O4Cu, Cu(II)) is a copper spin-1/2 system with a magnetic moment of 1.05 +/- 0.04 muB/molecule, slightly smaller than the 1.215+/-0.02 muB/molecule for the larger size copper spin-1/2 system C36H48N4O4Cu.C4H8O (bis(4-cyano-2,2,6,6-tetramethyl-3,5-heptanedionato)copper(II) 4,4"-bipyridylethene-THF). Metals 4-9 spindlin 1 Homo sapiens 286-292 17915934-2 2007 For certain metal surfaces, such as the Au(111) surface, the experimentally observed spin-orbit coupling results in spin rotation lengths on the order of tens of nanometers, which is the typical length scale associated with quantum corral structures formed on metal surfaces. Metals 12-17 spindlin 1 Homo sapiens 85-89 17915934-2 2007 For certain metal surfaces, such as the Au(111) surface, the experimentally observed spin-orbit coupling results in spin rotation lengths on the order of tens of nanometers, which is the typical length scale associated with quantum corral structures formed on metal surfaces. Metals 12-17 spindlin 1 Homo sapiens 116-120 17995275-1 2007 We are able to continuously change the direction of polarization of spin accumulation in a nonmagnetic metal by varying the currents injected by two ferromagnetic spin injectors. Metals 103-108 spindlin 1 Homo sapiens 68-72 17995275-1 2007 We are able to continuously change the direction of polarization of spin accumulation in a nonmagnetic metal by varying the currents injected by two ferromagnetic spin injectors. Metals 103-108 spindlin 1 Homo sapiens 163-167 17702173-4 2007 This observation stands in stark contrast to EPR results previously obtained for the related {(mu-L)[Ru(acac)2]2(n), n = + and -, both of which exhibit metal-centred spin. Metals 152-157 spindlin 1 Homo sapiens 166-170 17565764-5 2007 Spin centers may be metal ions, metal clusters, cofactor radicals, amino acid radicals, or spin labels. Metals 20-25 spindlin 1 Homo sapiens 0-4 17565764-5 2007 Spin centers may be metal ions, metal clusters, cofactor radicals, amino acid radicals, or spin labels. Metals 32-37 spindlin 1 Homo sapiens 0-4 17155762-3 2006 By comparing different contact materials (Al and/or Pt), we find, in agreement with theory, that the spin-related properties of the normal metal dictate the magnitude of the dc voltage. Metals 139-144 spindlin 1 Homo sapiens 101-105 16384290-4 2005 The sensitivity is enhanced by using a high-density alkali-metal vapor in a spin-exchange relaxation free regime. Metals 59-64 spindlin 1 Homo sapiens 76-80 16090286-1 2005 Quantum-well (QW) states in nonmagnetic metal films between magnetic layers are known to be important in spin-dependent transport, but QW states in magnetic films remains elusive. Metals 40-45 spindlin 1 Homo sapiens 105-109 15852126-7 2005 The thermal spin crossover process is accompanied by significant changes of the molecular structures as shown by the average variation of the metal-ligand bond distances which can be extrapolated for a complete spin conversion from ca. Metals 142-147 spindlin 1 Homo sapiens 12-16 15852126-7 2005 The thermal spin crossover process is accompanied by significant changes of the molecular structures as shown by the average variation of the metal-ligand bond distances which can be extrapolated for a complete spin conversion from ca. Metals 142-147 spindlin 1 Homo sapiens 211-215 15698311-2 2005 Low-energy quasiparticles in a normal metal (N) experience spin-dependent retroreflection at AF/N interfaces. Metals 38-43 spindlin 1 Homo sapiens 59-63 12470092-2 2002 However, calculations with reparametrized density functionals on molecules of the thermal spin-crossover type can give improved results when compared with experiment for close-lying states of different spin and are therefore important for, e.g., transition metal catalysis. Metals 257-262 spindlin 1 Homo sapiens 90-94 15303171-5 2004 Spin density distribution is used to analyse the nature of the coupling between the metal centres. Metals 84-89 spindlin 1 Homo sapiens 0-4 15106960-4 2004 The triplet state molecule 3 containing two spin doublet Cu(II)3 units connected by two m-phenylenediamidate bridges represents a successful extension of the concept of "ferromagnetic coupling units" to metal complexes, which is a well-known approach toward high spin organic radicals. Metals 203-208 spindlin 1 Homo sapiens 44-48 15106960-4 2004 The triplet state molecule 3 containing two spin doublet Cu(II)3 units connected by two m-phenylenediamidate bridges represents a successful extension of the concept of "ferromagnetic coupling units" to metal complexes, which is a well-known approach toward high spin organic radicals. Metals 203-208 spindlin 1 Homo sapiens 263-267 12596540-0 2003 Spin forbidden chemical reactions of transition metal compounds. Metals 48-53 spindlin 1 Homo sapiens 0-4 12596540-2 2003 Many reactions of transition metal compounds involve a change in spin. Metals 29-34 spindlin 1 Homo sapiens 65-69 12596540-8 2003 Density functional theory, especially using gradient-corrected and hybrid functionals, performs reasonably well for the difficult problem of predicting the energy splitting between different spin states of transition metal complexes, although careful calibration is needed. Metals 217-222 spindlin 1 Homo sapiens 191-195 14525224-0 2003 Spin coupling between cold atoms and the thermal fluctuations of a metal surface. Metals 67-72 spindlin 1 Homo sapiens 0-4 12470092-2 2002 However, calculations with reparametrized density functionals on molecules of the thermal spin-crossover type can give improved results when compared with experiment for close-lying states of different spin and are therefore important for, e.g., transition metal catalysis. Metals 257-262 spindlin 1 Homo sapiens 202-206 11289877-1 2001 The decay of spin memory in a 2D electron gas is found to be suppressed close to the metal-insulator transition. Metals 85-90 spindlin 1 Homo sapiens 13-17 11415299-0 2001 Spin fluctuations in a magnetically frustrated metal LiV(2)O(4). Metals 47-52 spindlin 1 Homo sapiens 0-4 11328118-2 2001 A substantial spin polarization for KLL Auger electrons emitted in the final stage of the neutralization sequence during the interaction of multicharged ions with a metal surface is observed. Metals 165-170 spindlin 1 Homo sapiens 14-18 12298022-5 2002 The low-spin addition of metal oxo species to an alkene leads to an intermediate which forms epoxide either with a barrier on the low-spin surface or without a barrier after spin inversion. Metals 25-30 spindlin 1 Homo sapiens 8-12 12298022-5 2002 The low-spin addition of metal oxo species to an alkene leads to an intermediate which forms epoxide either with a barrier on the low-spin surface or without a barrier after spin inversion. Metals 25-30 spindlin 1 Homo sapiens 134-138 12298022-5 2002 The low-spin addition of metal oxo species to an alkene leads to an intermediate which forms epoxide either with a barrier on the low-spin surface or without a barrier after spin inversion. Metals 25-30 spindlin 1 Homo sapiens 134-138 11689938-3 2001 Local injection of a spin-polarized current through an all-metal junction has been proposed as an efficient method of switching magnetic elements, and experiments seem to confirm this. Metals 59-64 spindlin 1 Homo sapiens 21-25 11461483-1 2001 Injection of spin polarized electrons from a metal into a semiconductor is demonstrated for a GaAs/(In,Ga)As light emitting diode covered with Fe. Metals 45-50 spindlin 1 Homo sapiens 13-17 11457070-2 2001 Applications of the code for the calculation of one-bond metal-ligand couplings of coordinatively unsaturated compounds containing (195)Pt and (199)Hg, including spin-orbit coupling or coordination effects by solvent molecules, show that relativistic density functional calculations are able to reproduce the experimental findings with good accuracy for the systems under investigation. Metals 57-62 spindlin 1 Homo sapiens 162-166 11019108-2 2000 We also show that the RS phases are unusual "spin-metals" with divergent low-frequency conductivity at T = 0, and follow the spin conductivity through "metal-insulator" transitions tuned by the strength of dimerization or Ising anisotropy in the spin-1/2 case and by the strength of disorder in the spin-1 case. Metals 50-55 spindlin 1 Homo sapiens 45-49 11019108-2 2000 We also show that the RS phases are unusual "spin-metals" with divergent low-frequency conductivity at T = 0, and follow the spin conductivity through "metal-insulator" transitions tuned by the strength of dimerization or Ising anisotropy in the spin-1/2 case and by the strength of disorder in the spin-1 case. Metals 50-55 spindlin 1 Homo sapiens 125-129 11019108-2 2000 We also show that the RS phases are unusual "spin-metals" with divergent low-frequency conductivity at T = 0, and follow the spin conductivity through "metal-insulator" transitions tuned by the strength of dimerization or Ising anisotropy in the spin-1/2 case and by the strength of disorder in the spin-1 case. Metals 50-55 spindlin 1 Homo sapiens 246-252 11019108-2 2000 We also show that the RS phases are unusual "spin-metals" with divergent low-frequency conductivity at T = 0, and follow the spin conductivity through "metal-insulator" transitions tuned by the strength of dimerization or Ising anisotropy in the spin-1/2 case and by the strength of disorder in the spin-1 case. Metals 50-55 spindlin 1 Homo sapiens 125-129 11669951-8 1997 The structural modifications associated with the spin change in 2 mainly consist of a large reorganization of the metal environment: the Fe-N decreases by 0.15 A (mean value) when the temperature is lowered from 290 to 139 K and a more regular shape of the [FeN(6)] octahedron is achieved through a slight modification of the trigonal deformation angle from 5.3 degrees to 3.2 degrees along with remarkable variations of the N-Fe-N angles. Metals 114-119 spindlin 1 Homo sapiens 49-53 11670788-2 1998 Equations are derived and discussed that allow the computation of zero-field splitting (ZFS) tensors in transition metal complexes for any value of the ground-state total spin S. An effective Hamiltonian technique is used and the calculation is carried to second order for orbitally nondegenerate ground states. Metals 115-120 spindlin 1 Homo sapiens 171-175 11670788-10 1998 Finally, contributions to the experimentally observed reduction of the metal spin-orbit coupling constants (the relativistic nephelauxetic effect) are discussed. Metals 71-76 spindlin 1 Homo sapiens 77-81 11670788-15 1998 Thus the use of free-ion values for spin-orbit coupling and related constants in the analysis of experimental data leads to values for MO coefficients that overestimate the metal-ligand covalency. Metals 173-178 spindlin 1 Homo sapiens 36-40 29711385-0 1998 A Spin-Frustrated System Composed of Organic Radicals and Magnetic Metal Ions. Metals 67-72 spindlin 1 Homo sapiens 2-6 9373904-6 1997 Spin-lattice relaxation rates (T1(-1)) for functional group nuclei increased as a function of percent surface coverage with metal ion. Metals 124-129 spindlin 1 Homo sapiens 0-4 9373904-9 1997 At higher surface coverages, calculated beta values reached a limiting value, indicating that while the spin-diffusion mechanism in metal-exchanged silica gels is restricted, it is not completely diminished. Metals 132-137 spindlin 1 Homo sapiens 104-108 11670874-1 1999 The potential value of electron spin delocalization as a means for substantially increasing the ability of a paramagnetic metal complex to induce nuclear spin relaxation of water protons has been examined by covalent attachment of bromine atoms in the beta-pyrrole positions of the [5,10,15,20-tetrakis(4-sulfonatophenyl)-21H,23H-porphine]manganese complexes[Mn(III)TPPS](3)(-) and [Mn(II)TPPS]. Metals 122-127 spindlin 1 Homo sapiens 32-36 11670874-1 1999 The potential value of electron spin delocalization as a means for substantially increasing the ability of a paramagnetic metal complex to induce nuclear spin relaxation of water protons has been examined by covalent attachment of bromine atoms in the beta-pyrrole positions of the [5,10,15,20-tetrakis(4-sulfonatophenyl)-21H,23H-porphine]manganese complexes[Mn(III)TPPS](3)(-) and [Mn(II)TPPS]. Metals 122-127 spindlin 1 Homo sapiens 154-158 11666592-0 1996 Ligand-Driven Light-Induced Spin Change in Transition-Metal Complexes: Selection of an Appropriate System and First Evidence of the Effect, in Fe(II)(4-styrylpyridine)(4)(NCBPh(3))(2). Metals 54-59 spindlin 1 Homo sapiens 28-32 11666592-1 1996 The first observation of a ligand-driven light-induced spin-state change (LD-LISC effect) in a transition-metal complex is reported. Metals 106-111 spindlin 1 Homo sapiens 55-59 9997620-0 1991 Spin-flip scattering near the metal-to-insulator transition in Cd0.95Mn0.05Se:In. Metals 30-35 spindlin 1 Homo sapiens 0-4 10011387-0 1994 Spin correlations in semiconductor dangling bonds: Implications for the alkali-metal-covered surfaces. Metals 79-84 spindlin 1 Homo sapiens 0-4 8161194-0 1994 Spin-trapping studies of peroxynitrite decomposition and of 3-morpholinosydnonimine N-ethylcarbamide autooxidation: direct evidence for metal-independent formation of free radical intermediates. Metals 136-141 spindlin 1 Homo sapiens 0-4 9996097-0 1990 Spin-orbit contribution to the Hall coefficient approaching the metal-insulator transition: An explanation for the critical behavior of Ge:Sb. Metals 64-69 spindlin 1 Homo sapiens 0-4 33784166-2 2021 Here, we report that spin backflow and spin-memory loss at Pt-based heavy metal-ferromagnet interfaces can be effectively eliminated by inserting an insulating paramagnetic NiO layer of optimum thickness. Metals 74-79 spindlin 1 Homo sapiens 21-25 33784166-2 2021 Here, we report that spin backflow and spin-memory loss at Pt-based heavy metal-ferromagnet interfaces can be effectively eliminated by inserting an insulating paramagnetic NiO layer of optimum thickness. Metals 74-79 spindlin 1 Homo sapiens 39-43 34860044-0 2021 Magnonic Unidirectional Spin Hall Magnetoresistance in a Heavy-Metal-Ferromagnetic-Insulator Bilayer. Metals 63-68 spindlin 1 Homo sapiens 24-28 34921706-0 2022 Spin-State Manipulation of Two-Dimensional Metal-Organic Framework with Enhanced Metal-Oxygen Covalency for Lithium-Oxygen Batteries. Metals 43-48 spindlin 1 Homo sapiens 0-4 34921706-0 2022 Spin-State Manipulation of Two-Dimensional Metal-Organic Framework with Enhanced Metal-Oxygen Covalency for Lithium-Oxygen Batteries. Metals 81-86 spindlin 1 Homo sapiens 0-4 34921706-2 2022 Herein, we regulate the spin state of partial Ni 2+ metal centers ( t 2g 6 e g 2 ) of conductive nickel catecholate framework (Ni II -NCF) nanowire arrays to high-valence Ni 3+ ( t 2g 6 e g 1 ) for Ni III -NCF. Metals 52-57 spindlin 1 Homo sapiens 24-28 34851330-1 2021 The fine-tuning of intermolecular or intramolecular non-covalent interactions (NCIs) and thus the precise synthesis of metal complexes in which the spin states can be controlled by NCIs remains challenging, even though several such complexes have been intensively studied. Metals 119-124 spindlin 1 Homo sapiens 148-152 34851330-3 2021 The complexes were co-crystallized with different solvent molecules to decipher the effect of the crystallized solvents on NCIs, and on the spin state of the metal ion. Metals 158-163 spindlin 1 Homo sapiens 140-144 34851330-5 2021 We present a first structure-property correlation between the nature of interaction of the (per)fluorinated aromatic substituents on the ligand periphery, and the spin state of the metal complexes. Metals 181-186 spindlin 1 Homo sapiens 163-167 34903793-6 2021 The results show that the considered junctions are half-metal with reduced thermal conductance which makes them a suitable spin-dependent thermoelectric device. Metals 56-61 spindlin 1 Homo sapiens 123-127 34876578-1 2021 Spin-orbit coupling effect in structures with broken inversion symmetry, known as the Rashba effect, facilitates spin-orbit torques (SOTs) in heavy metal/ferromagnet/oxide structures, along with the spin Hall effect. Metals 148-153 spindlin 1 Homo sapiens 0-4 34876578-1 2021 Spin-orbit coupling effect in structures with broken inversion symmetry, known as the Rashba effect, facilitates spin-orbit torques (SOTs) in heavy metal/ferromagnet/oxide structures, along with the spin Hall effect. Metals 148-153 spindlin 1 Homo sapiens 113-117 34876578-1 2021 Spin-orbit coupling effect in structures with broken inversion symmetry, known as the Rashba effect, facilitates spin-orbit torques (SOTs) in heavy metal/ferromagnet/oxide structures, along with the spin Hall effect. Metals 148-153 spindlin 1 Homo sapiens 199-203 34889637-1 2021 Spin-orbit Mott insulators composed of t_{2g}^{4} transition metal ions may host excitonic magnetism due to the condensation of spin-orbital J=1 triplons. Metals 61-66 spindlin 1 Homo sapiens 0-4 34889637-1 2021 Spin-orbit Mott insulators composed of t_{2g}^{4} transition metal ions may host excitonic magnetism due to the condensation of spin-orbital J=1 triplons. Metals 61-66 spindlin 1 Homo sapiens 128-132 34423529-7 2021 Our work expands spin-polarized charge transport in eco-friendly and stable metal-organic halides, which is promising to be applied in spintronics based on transition-metal hybrid systems. Metals 76-81 spindlin 1 Homo sapiens 17-21 34423529-7 2021 Our work expands spin-polarized charge transport in eco-friendly and stable metal-organic halides, which is promising to be applied in spintronics based on transition-metal hybrid systems. Metals 167-172 spindlin 1 Homo sapiens 17-21 34739276-6 2021 Our predictions can be readily verified by standard spin-transport measurements in metal alloys with Kondo impurities. Metals 83-88 spindlin 1 Homo sapiens 52-56 34623369-1 2021 Slater-Condon parameters and the spin-orbit (SO) coupling constants for various oxidation states of transition metal ions (3d/4d/5d) and trivalent f-block ions were calculated using minimal active space complete active space self-consistent field (CASSCF)-SO methods in OpenMolcas. Metals 111-116 spindlin 1 Homo sapiens 33-37 34473424-6 2021 These new insights may open up opportunities for exploiting efficient NRR electrocatalysts by atomically regulating the spin state of metal centers. Metals 134-139 spindlin 1 Homo sapiens 120-124 34757659-1 2022 Spin-crossover between high-spin (HS) and low-spin (LS) states of selected transition metal ions in polynuclear and polymeric compounds is behind their use as multistep switchable materials in breakthrough electronic and spintronic devices. Metals 86-91 spindlin 1 Homo sapiens 0-4 34757659-1 2022 Spin-crossover between high-spin (HS) and low-spin (LS) states of selected transition metal ions in polynuclear and polymeric compounds is behind their use as multistep switchable materials in breakthrough electronic and spintronic devices. Metals 86-91 spindlin 1 Homo sapiens 28-32 34757659-1 2022 Spin-crossover between high-spin (HS) and low-spin (LS) states of selected transition metal ions in polynuclear and polymeric compounds is behind their use as multistep switchable materials in breakthrough electronic and spintronic devices. Metals 86-91 spindlin 1 Homo sapiens 46-50 34908414-2 2022 The theoretical prediction and interpretation of metal L-edge X-ray absorption spectra are complicated by both relativistic effects, including spin-orbit coupling and the multiconfigurational nature of the states involved. Metals 49-54 spindlin 1 Homo sapiens 143-147 34905352-1 2021 Using a heavy-metal (HM) alloy layer in spin-orbit torque (SOT)-based devices is an effective method for obtaining a high current-spin conversion efficiency thetaSH. Metals 14-19 spindlin 1 Homo sapiens 40-44 34905352-1 2021 Using a heavy-metal (HM) alloy layer in spin-orbit torque (SOT)-based devices is an effective method for obtaining a high current-spin conversion efficiency thetaSH. Metals 14-19 spindlin 1 Homo sapiens 130-134 34874503-1 2021 We designed a simple on-chip integrated optical isolator made up of a metal-insulator-metal waveguide and a disc cavity filled with magneto-optical material to enhance the transverse magneto-optical effect through the coin paradox spin-orbit interaction (SOI). Metals 70-75 spindlin 1 Homo sapiens 231-235 34874503-1 2021 We designed a simple on-chip integrated optical isolator made up of a metal-insulator-metal waveguide and a disc cavity filled with magneto-optical material to enhance the transverse magneto-optical effect through the coin paradox spin-orbit interaction (SOI). Metals 86-91 spindlin 1 Homo sapiens 231-235 34767709-1 2021 Metal-halide perovskite semiconductors have attracted attention for opto-spintronic applications where the manipulation of charge and spin degrees of freedom have the potential to lower power consumption and achieve faster switching times for electronic devices. Metals 0-5 spindlin 1 Homo sapiens 134-138 34699234-0 2021 Transition Metal Synthetic Ferrimagnets: Tunable Media for All-Optical Switching Driven by Nanoscale Spin Current. Metals 11-16 spindlin 1 Homo sapiens 101-105 34632759-0 2021 Templated Growth of a Spin-Frustrated Cluster Fragment of MnBr2 in a Metal-Organic Framework. Metals 69-74 spindlin 1 Homo sapiens 22-26 34632759-1 2021 The metal-organic framework Zr6O4(OH)4(bpydc)6 (bpydc2- = 2,2"-bipyridine-5,5"-dicarboxylate) is used to template the growth of a cluster fragment of the two-dimensional solid MnBr2, which was predicted to exhibit spin frustration. Metals 4-9 spindlin 1 Homo sapiens 214-218 34558910-0 2021 Study of Spin-Orbit Interactions and Interlayer Ferromagnetic Coupling in Co/Pt/Co Trilayers in a Wide Range of Heavy-Metal Thickness. Metals 118-123 spindlin 1 Homo sapiens 9-13 34558910-1 2021 The spin-orbit torque, a torque induced by a charge current flowing through the heavy-metal-conducting layer with strong spin-orbit interactions, provides an efficient way to control the magnetization direction in heavy-metal/ferromagnet nanostructures, required for applications in the emergent magnetic technologies like random access memories, high-frequency nano-oscillators, or bioinspired neuromorphic computations. Metals 86-91 spindlin 1 Homo sapiens 4-8 34558910-1 2021 The spin-orbit torque, a torque induced by a charge current flowing through the heavy-metal-conducting layer with strong spin-orbit interactions, provides an efficient way to control the magnetization direction in heavy-metal/ferromagnet nanostructures, required for applications in the emergent magnetic technologies like random access memories, high-frequency nano-oscillators, or bioinspired neuromorphic computations. Metals 86-91 spindlin 1 Homo sapiens 121-125 34558910-1 2021 The spin-orbit torque, a torque induced by a charge current flowing through the heavy-metal-conducting layer with strong spin-orbit interactions, provides an efficient way to control the magnetization direction in heavy-metal/ferromagnet nanostructures, required for applications in the emergent magnetic technologies like random access memories, high-frequency nano-oscillators, or bioinspired neuromorphic computations. Metals 220-225 spindlin 1 Homo sapiens 4-8 34558910-1 2021 The spin-orbit torque, a torque induced by a charge current flowing through the heavy-metal-conducting layer with strong spin-orbit interactions, provides an efficient way to control the magnetization direction in heavy-metal/ferromagnet nanostructures, required for applications in the emergent magnetic technologies like random access memories, high-frequency nano-oscillators, or bioinspired neuromorphic computations. Metals 220-225 spindlin 1 Homo sapiens 121-125 34514790-0 2021 Strain-Controlled Spin Transition in Heterostructured Metal-Organic Framework Thin Film. Metals 54-59 spindlin 1 Homo sapiens 18-22 34472336-4 2021 Our results demonstrate that mitrofanovite is a topological metal with termination-dependent (i) electronic band structure and (ii) spin texture. Metals 60-65 spindlin 1 Homo sapiens 132-136 34268813-4 2021 By introducing a unique structural difference, i.e. metal-cage binding site, while keeping other molecular parameters constant between different complexes, these manifest the key role of the three low energy metal-based vibrations in mediating the spin-lattice relaxation times ( T 1 ). Metals 52-57 spindlin 1 Homo sapiens 248-252 34268813-4 2021 By introducing a unique structural difference, i.e. metal-cage binding site, while keeping other molecular parameters constant between different complexes, these manifest the key role of the three low energy metal-based vibrations in mediating the spin-lattice relaxation times ( T 1 ). Metals 208-213 spindlin 1 Homo sapiens 248-252 34558931-3 2021 Systematic angle and frequency-dependent measurements demonstrate that the observed spin-pumping signals arise from resonance-induced spin injection and inverse spin Hall effect in alpha-Fe_{2}O_{3}-metal heterostructures, mimicking the behavior of spin pumping in conventional ferromagnet-nonmagnet systems. Metals 199-204 spindlin 1 Homo sapiens 84-88 34558931-3 2021 Systematic angle and frequency-dependent measurements demonstrate that the observed spin-pumping signals arise from resonance-induced spin injection and inverse spin Hall effect in alpha-Fe_{2}O_{3}-metal heterostructures, mimicking the behavior of spin pumping in conventional ferromagnet-nonmagnet systems. Metals 199-204 spindlin 1 Homo sapiens 134-138 34558931-3 2021 Systematic angle and frequency-dependent measurements demonstrate that the observed spin-pumping signals arise from resonance-induced spin injection and inverse spin Hall effect in alpha-Fe_{2}O_{3}-metal heterostructures, mimicking the behavior of spin pumping in conventional ferromagnet-nonmagnet systems. Metals 199-204 spindlin 1 Homo sapiens 161-165 34432475-1 2021 The electrocatalytic activity of transition-metal (TM)-based catalysts is correlated with the spin states of metal atoms. Metals 44-49 spindlin 1 Homo sapiens 94-98 34432475-1 2021 The electrocatalytic activity of transition-metal (TM)-based catalysts is correlated with the spin states of metal atoms. Metals 109-114 spindlin 1 Homo sapiens 94-98 34379389-5 2021 In the d1 complexes, the spin is primarily localized on the metal (~55-77% Mo dxy) with delocalization on the triply bonded carbon of ~0.05-0.09 e-. Metals 60-65 spindlin 1 Homo sapiens 25-29 34476286-1 2021 We report strong amplification of the photomagnetic spin precession in Co-doped YIG employing a surface plasmon excitation in a metal-dielectric magneto-plasmonic crystal. Metals 128-133 spindlin 1 Homo sapiens 52-56 34260255-0 2021 Following Metal-to-Ligand Charge-Transfer Dynamics with Ligand and Spin Specificity Using Femtosecond Resonant Inelastic X-ray Scattering at the Nitrogen K-Edge. Metals 10-15 spindlin 1 Homo sapiens 67-71 34251803-0 2021 Metal Ion Control of Photoinduced Electron Spin Polarization in Electronic Ground States. Metals 0-5 spindlin 1 Homo sapiens 43-47 34251803-1 2021 Both the sign and intensity of photoinduced electron spin polarization (ESP) in the electronic ground state doublet (2S0/D0) of chromophore-radical complexes can be controlled by changing the nature of the metal ion. Metals 206-211 spindlin 1 Homo sapiens 53-57 34202878-0 2021 Spin Polarization Properties of Two Dimensional GaP3 Induced by 3d Transition-Metal Doping. Metals 78-83 spindlin 1 Homo sapiens 0-4 34202878-1 2021 The electronic structure and spin polarization properties of monolayer GaP3 induced by transition metal (TM) doping were investigated through a first-principles calculation based on density functional theory. Metals 98-103 spindlin 1 Homo sapiens 29-33 34096277-0 2021 Near Isotropic D4d Spin Qubits as Nodes of a Gd(III)-Based Metal-Organic Framework. Metals 59-64 spindlin 1 Homo sapiens 19-23 34551530-8 2021 We then present the first MR-DSRG application on transition-metal complexes by computing the spin splittings of the (Fe(H2O)6)2+ and (Fe(NH3)6)2+ molecules. Metals 60-65 spindlin 1 Homo sapiens 93-97 34498843-1 2021 The Fe(II) low-spin (LS; 1A1g, t2g6eg0) high-spin (HS; 5T2g, t2g4eg2) light-induced excited spin state trapping (LIESST) mechanism solely involving metal-centered states is revealed by synergistic spin-vibronic dynamics simulations. Metals 150-155 spindlin 1 Homo sapiens 15-19 34498843-1 2021 The Fe(II) low-spin (LS; 1A1g, t2g6eg0) high-spin (HS; 5T2g, t2g4eg2) light-induced excited spin state trapping (LIESST) mechanism solely involving metal-centered states is revealed by synergistic spin-vibronic dynamics simulations. Metals 150-155 spindlin 1 Homo sapiens 47-51 34498843-1 2021 The Fe(II) low-spin (LS; 1A1g, t2g6eg0) high-spin (HS; 5T2g, t2g4eg2) light-induced excited spin state trapping (LIESST) mechanism solely involving metal-centered states is revealed by synergistic spin-vibronic dynamics simulations. Metals 150-155 spindlin 1 Homo sapiens 94-98 34498843-1 2021 The Fe(II) low-spin (LS; 1A1g, t2g6eg0) high-spin (HS; 5T2g, t2g4eg2) light-induced excited spin state trapping (LIESST) mechanism solely involving metal-centered states is revealed by synergistic spin-vibronic dynamics simulations. Metals 150-155 spindlin 1 Homo sapiens 199-203 34410727-1 2021 The coupled spin and valley degrees of freedom in transition metal dichalcogenides (TMDs) are considered a promising platform for information processing. Metals 61-66 spindlin 1 Homo sapiens 12-16 34533330-0 2021 Quantum Spin State Selectivity and Magnetic Tuning of Ultracold Chemical Reactions of Triplet Alkali-Metal Dimers with Alkali-Metal Atoms. Metals 101-106 spindlin 1 Homo sapiens 8-12 34549118-3 2021 It is suggested to fit the Hubbard correction for the metal dopant atom by taking as reference the observed low spin-high spin (HS) energy difference for the metal atom. Metals 54-59 spindlin 1 Homo sapiens 112-116 34549118-3 2021 It is suggested to fit the Hubbard correction for the metal dopant atom by taking as reference the observed low spin-high spin (HS) energy difference for the metal atom. Metals 54-59 spindlin 1 Homo sapiens 122-126 34549118-3 2021 It is suggested to fit the Hubbard correction for the metal dopant atom by taking as reference the observed low spin-high spin (HS) energy difference for the metal atom. Metals 158-163 spindlin 1 Homo sapiens 112-116 34549118-3 2021 It is suggested to fit the Hubbard correction for the metal dopant atom by taking as reference the observed low spin-high spin (HS) energy difference for the metal atom. Metals 158-163 spindlin 1 Homo sapiens 122-126 34380320-1 2021 Spin-orbit torque phenomena enable efficient manipulation of the magnetization in ferromagnet/heavy metal bilayer systems for prospective magnetic memory and logic applications. Metals 100-105 spindlin 1 Homo sapiens 0-4 34338523-1 2021 Spin-orbit coupling is especially critical for the description of magnetic anisotropy, electron paramagnetic resonance spectroscopy of inorganic radicals and transition-metal complexes, and intersystem crossing. Metals 169-174 spindlin 1 Homo sapiens 0-4 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 105-110 spindlin 1 Homo sapiens 71-75 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 105-110 spindlin 1 Homo sapiens 286-290 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 105-110 spindlin 1 Homo sapiens 346-350 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 116-121 spindlin 1 Homo sapiens 71-75 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 116-121 spindlin 1 Homo sapiens 286-290 34376676-3 2021 Herein, we propose a simple magnetic-stimulation approach to rearrange spin electron occupation in noble-metal-free metal-organic frameworks (MOFs) with a feature of thermal-differentiated superlattice, in which the localized magnetic heating in periodic spatial distribution makes the spin flip occur at particular active sites, demonstrating a spin-dependent reaction pathway. Metals 116-121 spindlin 1 Homo sapiens 346-350 34296865-11 2021 The photophysical and ground state properties (quantum yield, lifetime, redox potential, and acid/base) of this spin-flip complex incorporating an earth-abundant metal surpass those of the classical precious metal (Ru(alpha-diimine)3)2+ charge transfer complexes, which are commonly employed in optical sensing and photo(redox) catalysis, underlining the bright future of these molecular ruby analogues. Metals 162-167 spindlin 1 Homo sapiens 112-116 34614895-2 2021 This strategy is based on the application of a spin-decoupled phase metasurface composed by only one set of metal-insulator-metal (MIM) umbrella-shaped chiral unit cells. Metals 108-113 spindlin 1 Homo sapiens 47-51 34614895-2 2021 This strategy is based on the application of a spin-decoupled phase metasurface composed by only one set of metal-insulator-metal (MIM) umbrella-shaped chiral unit cells. Metals 124-129 spindlin 1 Homo sapiens 47-51 34168836-1 2021 We report on the discovery and detailed exploration of the unconventional photo-switching mechanism in metallofullerenes, in which the energy of the photon absorbed by the carbon cage pi-system is transformed to mechanical motion of the endohedral cluster accompanied by accumulation of spin density on the metal atoms. Metals 307-312 spindlin 1 Homo sapiens 287-291 34168836-10 2021 The systematic increase of the metal contribution to the triplet spin density from Y3N to Sc3N found in the ENDOR study points to a substantial fullerene-to-metal charge transfer in the excited state. Metals 31-36 spindlin 1 Homo sapiens 65-69 35582788-0 2022 Reconciling Local Coupled Cluster with Multireference Approaches for Transition Metal Spin-State Energetics. Metals 80-85 spindlin 1 Homo sapiens 86-90 35582788-1 2022 Spin-state energetics of transition metal complexes remain one of the most challenging targets for electronic structure methods. Metals 36-41 spindlin 1 Homo sapiens 0-4 35582788-7 2022 The latter practically eliminates errors arising from the default truncation of electron-pair correlation spaces and should be viewed as standard practice in applications of the method to transition metal spin-state energetics. Metals 199-204 spindlin 1 Homo sapiens 205-209 35437988-2 2022 Here, using first-principles calculations we identify that the two-dimensional ferromagnetic metal organic framework of Mn2C18H12 can serve as a highly efficient single-atom catalyst for spin-triplet O2 activation and CO oxidation. Metals 93-98 spindlin 1 Homo sapiens 187-191 35442686-1 2022 Ferromagnet/heavy metal bilayers represent a central building block for spintronic devices where the magnetization of the ferromagnet can be controlled by spin currents generated in the heavy metal. Metals 18-23 spindlin 1 Homo sapiens 155-159 35442686-1 2022 Ferromagnet/heavy metal bilayers represent a central building block for spintronic devices where the magnetization of the ferromagnet can be controlled by spin currents generated in the heavy metal. Metals 192-197 spindlin 1 Homo sapiens 155-159 35442686-4 2022 Here, we show theoretically and experimentally that for Ta as heavy metal the interface only partially transmits the spin current while this effect is absent when Pt is used as heavy metal. Metals 68-73 spindlin 1 Homo sapiens 117-121 35442686-4 2022 Here, we show theoretically and experimentally that for Ta as heavy metal the interface only partially transmits the spin current while this effect is absent when Pt is used as heavy metal. Metals 183-188 spindlin 1 Homo sapiens 117-121 34240907-1 2021 In this work, we provide a nuanced view of electron correlation in the context of transition metal complexes, reconciling computational characterization via spin and spatial symmetry breaking in single-reference methods with qualitative concepts from ligand-field and molecular orbital theories. Metals 93-98 spindlin 1 Homo sapiens 157-161 34168836-10 2021 The systematic increase of the metal contribution to the triplet spin density from Y3N to Sc3N found in the ENDOR study points to a substantial fullerene-to-metal charge transfer in the excited state. Metals 157-162 spindlin 1 Homo sapiens 65-69 35630963-1 2022 We review the current understanding of the time scale and mechanisms associated with the change in spin state in transition metal-based spin crossover (SCO) molecular complexes. Metals 124-129 spindlin 1 Homo sapiens 99-103 35630963-1 2022 We review the current understanding of the time scale and mechanisms associated with the change in spin state in transition metal-based spin crossover (SCO) molecular complexes. Metals 124-129 spindlin 1 Homo sapiens 136-140 35512338-3 2022 Kinetically stabilized species, such as octahedral low-spin d6 transition metal complexes, are not expected to participate directly in these reactions. Metals 74-79 spindlin 1 Homo sapiens 55-59 35247217-1 2022 Exploring functional substrates and precisely regulating the electronic structures of atomic metal active species with moderate spin state are of great importance yet remain challenging. Metals 93-98 spindlin 1 Homo sapiens 128-132 35476388-0 2022 Power-Dependent Characteristics of Spin Current Transfer in Metal Bilayer Devices under High-Power Pulse Excitation. Metals 60-65 spindlin 1 Homo sapiens 35-39 35604151-6 2022 Dual-functional Ti(IV)-immobilized metal affinity chromatography is used to separate various forms of glycosylation and phosphorylation simultaneously in multiple fractions in a convenient spin tip-based method, allowing downstream analyses of potential PTM crosstalk interactions. Metals 35-40 spindlin 1 Homo sapiens 189-193 35585034-0 2022 Optical Activity of Spin-Forbidden Electronic Transitions in Metal Complexes from Time-Dependent Density Functional Theory with Spin-Orbit Coupling. Metals 61-66 spindlin 1 Homo sapiens 20-24 35585034-0 2022 Optical Activity of Spin-Forbidden Electronic Transitions in Metal Complexes from Time-Dependent Density Functional Theory with Spin-Orbit Coupling. Metals 61-66 spindlin 1 Homo sapiens 128-132 35354123-5 2022 For metal-support interactions, surface spin polarization enhances the bonding between Pt nanoparticles and ceria surface oxygen, while CO adsorption on Pt nanoparticles weakens the interfacial interaction regardless of spin polarization. Metals 4-9 spindlin 1 Homo sapiens 40-44 35389645-1 2022 We report a new physical phenomenon of active and enhanced control of the spin Hall conductivity (SHC) in a family of metal-ferroelectric multilayers. Metals 118-123 spindlin 1 Homo sapiens 74-78 35395887-2 2022 In transition-metal complexes, the presence of heavy atoms results in a stronger spin-orbit coupling, which enables spin forbidden spin-crossover processes to compete with the spin-allowed internal conversion processes. Metals 14-19 spindlin 1 Homo sapiens 81-85 35298155-6 2022 It also provides spin-resolved reduced density matrices, important for the investigation of spin-dependent properties in polynuclear transition metal clusters, such as the hyperfine-coupling constants. Metals 144-149 spindlin 1 Homo sapiens 17-21 35298155-6 2022 It also provides spin-resolved reduced density matrices, important for the investigation of spin-dependent properties in polynuclear transition metal clusters, such as the hyperfine-coupling constants. Metals 144-149 spindlin 1 Homo sapiens 92-96 35354843-1 2022 We investigate spin thermoelectric properties of a hybrid system consisting of a single-level quantum dot attached to magnetic insulator and metal electrodes. Metals 141-146 spindlin 1 Homo sapiens 15-19 35277904-0 2022 The Decisive Role of Spin States and Spin Coupling in Dictating Selective O2 Adsorption in Chromium(II) Metal-Organic Frameworks. Metals 104-109 spindlin 1 Homo sapiens 21-25 35277904-0 2022 The Decisive Role of Spin States and Spin Coupling in Dictating Selective O2 Adsorption in Chromium(II) Metal-Organic Frameworks. Metals 104-109 spindlin 1 Homo sapiens 37-41 35247169-3 2022 This gave rise to strongly phosphorescent CrIII complexes with a d3 electronic configuration featuring luminescent metal-centered excited states which are characterized by the flip of a single spin. Metals 115-120 spindlin 1 Homo sapiens 193-197 35236883-4 2022 The analyzed major reasons are improved spin Hall angle represented as the changed resistivity of heavy metal layer and the reduction of surface anisotropy energy at interface between heavy metal and ferromagnet. Metals 104-109 spindlin 1 Homo sapiens 40-44 35236883-4 2022 The analyzed major reasons are improved spin Hall angle represented as the changed resistivity of heavy metal layer and the reduction of surface anisotropy energy at interface between heavy metal and ferromagnet. Metals 190-195 spindlin 1 Homo sapiens 40-44 35147025-2 2022 Our work proposes a technique to modulate the spin reflection and spin density of states within a heavy-metal Pt through interfacing with a dielectric MgO layer. Metals 104-109 spindlin 1 Homo sapiens 46-50 35147025-2 2022 Our work proposes a technique to modulate the spin reflection and spin density of states within a heavy-metal Pt through interfacing with a dielectric MgO layer. Metals 104-109 spindlin 1 Homo sapiens 66-70 35147025-5 2022 We analyze and attribute the complex interaction to spin reflection at the dielectric/heavy metal interface and spin scattering within the dielectric medium due to interfacial electric fields. Metals 92-97 spindlin 1 Homo sapiens 52-56 35129331-0 2022 Direct Observation of Modulated Radical Spin States in Metal-Organic Frameworks by Controlled Flexibility. Metals 55-60 spindlin 1 Homo sapiens 40-44 35179915-0 2022 Recombination Time Mismatch and Spin Dependent Photocurrent at a Ferromagnetic-Metal-Semiconductor Tunnel Junction. Metals 79-84 spindlin 1 Homo sapiens 32-36 35179915-1 2022 We report on carrier dynamics in a spin photodiode based on a ferromagnetic-metal-GaAs tunnel junction. Metals 76-81 spindlin 1 Homo sapiens 35-39 34505748-1 2022 We present a spin-orbit configuration interaction program which has been tailored for the description of the magnetic properties of polynuclear metal complexes with partially filled d- and f-shells. Metals 144-149 spindlin 1 Homo sapiens 13-17 35468253-0 2022 Theory-Guided Regulation of FeN4 Spin State by Neighboring Cu Atoms for Enhanced Oxygen Reduction Electrocatalysis in Flexible Metal-Air Batteries. Metals 127-132 spindlin 1 Homo sapiens 33-37 35454506-5 2022 We show that the insertion of a 1-nm-thick metal layer between YIG and GGG already increases the effective damping parameter enough to efficiently absorb spin waves. Metals 43-48 spindlin 1 Homo sapiens 154-158 35454506-7 2022 Investigating the dispersionless propagation of spin-wave packets, we demonstrate that a damping unit consisting of the YIG/metal bilayers can dissipate incident spin-wave signals with reflection coefficient R < 0.1 at a distance comparable to the spatial width of the wave packet. Metals 124-129 spindlin 1 Homo sapiens 48-52 35454506-7 2022 Investigating the dispersionless propagation of spin-wave packets, we demonstrate that a damping unit consisting of the YIG/metal bilayers can dissipate incident spin-wave signals with reflection coefficient R < 0.1 at a distance comparable to the spatial width of the wave packet. Metals 124-129 spindlin 1 Homo sapiens 162-166 35395887-2 2022 In transition-metal complexes, the presence of heavy atoms results in a stronger spin-orbit coupling, which enables spin forbidden spin-crossover processes to compete with the spin-allowed internal conversion processes. Metals 14-19 spindlin 1 Homo sapiens 116-120 35395887-2 2022 In transition-metal complexes, the presence of heavy atoms results in a stronger spin-orbit coupling, which enables spin forbidden spin-crossover processes to compete with the spin-allowed internal conversion processes. Metals 14-19 spindlin 1 Homo sapiens 131-135 35395887-2 2022 In transition-metal complexes, the presence of heavy atoms results in a stronger spin-orbit coupling, which enables spin forbidden spin-crossover processes to compete with the spin-allowed internal conversion processes. Metals 14-19 spindlin 1 Homo sapiens 176-180 35431660-8 2022 The hysteretic spin transitions in 1X 2 Me2CO and 1X 2 sf do not involve a crystallographic phase change but are accompanied by a significant rearrangement of the metal coordination sphere. Metals 165-170 spindlin 1 Homo sapiens 15-19 35148106-1 2022 Spin-orbit quartet ground states are associated with rich phenomenology, ranging from multipolar phases in f1 rare-earth borides to magnetism emerging through covalency and vibronic couplings in d1 transition-metal compounds. Metals 209-214 spindlin 1 Homo sapiens 0-4 34860044-1 2021 We report the observation of the unidirectional spin Hall magnetoresistance (USMR), which depends on the current or magnetization direction, in heavy-metal-ferromagnetic-insulator bilayer, Pt-Y_{3}Fe_{5}O_{12} (YIG). Metals 150-155 spindlin 1 Homo sapiens 48-52 10031176-0 1985 Spin-rotation interaction of noble-gas alkali-metal atom pairs. Metals 46-51 spindlin 1 Homo sapiens 0-4 9895742-0 1985 Spin-exchange cross sections for hydrogen-atom-alkali-metal-atom collisions. Metals 54-59 spindlin 1 Homo sapiens 0-4 218574-0 1979 Scalar coupling between 31P and spin-1/2 metal nuclides in 31P NMR of complexes with a ligand containing phosphonate donor groups. Metals 41-46 spindlin 1 Homo sapiens 32-40 33899284-5 2021 Here, by studying spin transport in a magnetic-metal/magnetic-insulator/platinum multilayer, it is demonstrated that coherent magnons can transfer spins efficiently above the magnon bandgap of magnetic insulators. Metals 47-52 spindlin 1 Homo sapiens 18-22 164224-10 1975 This indicates that the metal ion site (Kd equals 0.7 mM) is close to both types of spin label. Metals 24-29 spindlin 1 Homo sapiens 84-88 164224-11 1975 Measurements of the effect of gadolinium-protein binding on the relaxation rate of solvent water protons enable the enzyme-bound spin label-metal ion distances to be tentatively estimated as 15 angstrom. Metals 140-145 spindlin 1 Homo sapiens 129-133 5263759-3 1970 From a comparison of the experimental results with molecular orbital calculations, a mechanism for transfer of spin from the metal to the retinyl Schiff"s base and its subsequent delocalization down the polyene chain is provided. Metals 125-130 spindlin 1 Homo sapiens 111-115 34048648-0 2021 Resolution of Low-Energy States in Spin-Exchange Transition-Metal Clusters: Case Study of Singlet States in [Fe(III)4S4] Cubanes. Metals 60-65 spindlin 1 Homo sapiens 35-39 34048648-1 2021 Polynuclear transition-metal (PNTM) clusters owe their catalytic activity to numerous energetically low-lying spin states and stable oxidation states. Metals 23-28 spindlin 1 Homo sapiens 110-114 34043842-2 2021 For a d 2 electron configuration of the N MF3 compounds in C 3v symmetry Hund"s rule predict a high-spin 3 A 2 ground state with two parallel spin electrons and two degenerate metal d (delta)-orbitals. Metals 176-181 spindlin 1 Homo sapiens 100-104 33945276-5 2021 Moreover, because of the strong cooperativity of the spin centers, a dramatic red-to-yellow color change of crystals in response to a minute thermal perturbation around 303 K is triggered by an abrupt spin transition of the metal centers. Metals 224-229 spindlin 1 Homo sapiens 53-57 33945276-5 2021 Moreover, because of the strong cooperativity of the spin centers, a dramatic red-to-yellow color change of crystals in response to a minute thermal perturbation around 303 K is triggered by an abrupt spin transition of the metal centers. Metals 224-229 spindlin 1 Homo sapiens 201-205 34047602-6 2021 We use a recently developed time-dependent density matrix renormalization group approach to quantum STT to predict how injection of a spin-polarized current pulse into a normal metal layer coupled to an AFMI overlayer via exchange interaction and possibly small interlayer hopping-mimicking, e.g., topological-insulator/NiO bilayer employed experimentally-will induce a nonzero expectation value of AFMI localized spins. Metals 177-182 spindlin 1 Homo sapiens 134-138 34047606-0 2021 Spin-Flip Diffusion Length in 5d Transition Metal Elements: A First-Principles Benchmark. Metals 44-49 spindlin 1 Homo sapiens 0-4 33949543-0 2021 Water-assisted spin-flop antiferromagnetic behaviour of hydrophobic Cu-based metal-organic frameworks. Metals 77-82 spindlin 1 Homo sapiens 15-19 34018804-2 2021 Using a bilayer of hematite/heavy metal as a model system, we measure at room temperature the antiferromagnetic resonance and an associated inverse spin-Hall voltage, as large as in collinear antiferromagnets. Metals 34-39 spindlin 1 Homo sapiens 148-152 33934262-1 2021 A new type of spin-current filter is proposed that consists of a single-molecule magnet (SMM) coupled to two normal metal electrodes. Metals 116-121 spindlin 1 Homo sapiens 14-18 33730136-3 2021 This review presents a discussion of such soft metal complexes with a focus on spin crossover (SCO) behaviours that are associated with a structural phase transition, including a liquid crystal (LC) transition, arising from the flexible natures of the respective complexes. Metals 47-52 spindlin 1 Homo sapiens 79-83 33855760-1 2021 In the past decade, transition metal complexes have gained momentum as electron spin-based quantum bit (qubit) candidates due to their synthetic tunability and long achievable coherence times. Metals 31-36 spindlin 1 Homo sapiens 80-84 33759530-3 2021 Here, it is demonstrated that molecular vibrations give rise to molecular charge redistribution and accompany spin-polarization when coupling a chiral molecule to a nonmagnetic metal. Metals 177-182 spindlin 1 Homo sapiens 110-114 33826346-6 2021 We demonstrate the transferability of our approach on representative transition-metal complexes with a range of ligand field strengths, electron configurations (i.e., from Sc to Zn), and spin states. Metals 80-85 spindlin 1 Homo sapiens 187-191 33314912-1 2021 The properties of transition metal compounds are largely determined by nontrivial interplay of different degrees of freedom: charge, spin, lattice, and also orbital ones. Metals 29-34 spindlin 1 Homo sapiens 133-137 33405901-1 2021 The spin-forbidden nature of phosphorescence in Ir(III) complexes is relaxed by the metal-induced effect of spin-orbit coupling (SOC). Metals 84-89 spindlin 1 Homo sapiens 4-8 33709738-1 2021 We investigate the injection of quasiparticle spin currents into a superconductor via spin pumping from an adjacent ferromagnetic metal layer. Metals 130-135 spindlin 1 Homo sapiens 46-50 33709738-1 2021 We investigate the injection of quasiparticle spin currents into a superconductor via spin pumping from an adjacent ferromagnetic metal layer. Metals 130-135 spindlin 1 Homo sapiens 86-90 33635697-0 2021 Odd-Parity Spin-Triplet Superconductivity in Centrosymmetric Antiferromagnetic Metals. Metals 79-85 spindlin 1 Homo sapiens 11-15 33022879-2 2021 The influence of the spin on the mode of binding between carbon dioxide (CO 2 ) and a transition metal (TM) center is an entirely open question. Metals 97-102 spindlin 1 Homo sapiens 21-25 33022879-5 2021 On the high-spin surface (S = 5/2), the product complex features a bent carbon dioxide radical anion ligand that is O-"end-on"-bound to the metal. Metals 140-145 spindlin 1 Homo sapiens 12-16 33498031-2 2021 Although it has been shown that the structures have no significant spin polarization in a specific range of energy of electrons, by applying a transverse electric field in the sheet of the metal atoms, shedding light on the sample, and under a small bias voltage, a significant spin polarization in the structure could be created. Metals 189-194 spindlin 1 Homo sapiens 278-282 33313617-8 2021 The present study is an important step toward establishing an extensive and representative benchmark set of experiment-derived spin-state energetics for transition metal complexes. Metals 164-169 spindlin 1 Homo sapiens 127-131 33319894-0 2021 Behind the scenes of spin-forbidden decay pathways in transition metal complexes. Metals 65-70 spindlin 1 Homo sapiens 21-25 33523974-2 2021 Under excitation of surface acoustic wave (SAW), we find that a spin current flows orthogonal to the SAW propagation in nonmagnetic metals (NMs). Metals 132-138 spindlin 1 Homo sapiens 64-68 33523974-3 2021 The acoustic spin Hall effect manifests itself in a field-dependent acoustic voltage in NM/ferromagnetic metal bilayers. Metals 105-110 spindlin 1 Homo sapiens 13-17 32986270-2 2021 Room temperature conversion of metal-ion sites from high-spin to low-spin states under high-pressure-driven uptake of guest molecules was investigated. Metals 31-36 spindlin 1 Homo sapiens 69-73 33167619-3 2020 We find that although the CISS effect is entirely attributed in the literature to molecular spin filtering, spin-orbit coupling being partially inherited from the metal electrodes plays an important role in our calculations on ideal carbon helices, even though this effect cannot explain the experimental conductance results. Metals 163-168 spindlin 1 Homo sapiens 108-112 33464882-9 2021 Despite the difference in coordination environment, the weak OMe donors do not significantly alter the electronic structure or ligand-field splitting, and the occurrence of spin-crossover (similar to the compounds lacking the OMe groups) originates from a large degree of metal-ligand pi-covalency. Metals 272-277 spindlin 1 Homo sapiens 173-177 32986270-2 2021 Room temperature conversion of metal-ion sites from high-spin to low-spin states under high-pressure-driven uptake of guest molecules was investigated. Metals 31-36 spindlin 1 Homo sapiens 57-61 33170013-0 2020 An Ideal Spin Filter: Long-Range, High-Spin Selectivity in Chiral Helicoidal 3-Dimensional Metal Organic Frameworks. Metals 91-96 spindlin 1 Homo sapiens 9-13 33170013-0 2020 An Ideal Spin Filter: Long-Range, High-Spin Selectivity in Chiral Helicoidal 3-Dimensional Metal Organic Frameworks. Metals 91-96 spindlin 1 Homo sapiens 39-43 33170013-1 2020 An enantiopure, conductive, and paramagnetic crystalline 3-D metal-organic framework (MOF), based on Dy(III) and the l-tartrate chiral ligand, is proved to behave as an almost ideal electron spin filtering material at room temperature, transmitting one spin component only, leading to a spin polarization (SP) power close to 100% in the +-2 V range, which is conserved over a long spatial range, larger than 1 mum in some cases. Metals 61-66 spindlin 1 Homo sapiens 191-195 33170013-1 2020 An enantiopure, conductive, and paramagnetic crystalline 3-D metal-organic framework (MOF), based on Dy(III) and the l-tartrate chiral ligand, is proved to behave as an almost ideal electron spin filtering material at room temperature, transmitting one spin component only, leading to a spin polarization (SP) power close to 100% in the +-2 V range, which is conserved over a long spatial range, larger than 1 mum in some cases. Metals 61-66 spindlin 1 Homo sapiens 253-257 33170013-1 2020 An enantiopure, conductive, and paramagnetic crystalline 3-D metal-organic framework (MOF), based on Dy(III) and the l-tartrate chiral ligand, is proved to behave as an almost ideal electron spin filtering material at room temperature, transmitting one spin component only, leading to a spin polarization (SP) power close to 100% in the +-2 V range, which is conserved over a long spatial range, larger than 1 mum in some cases. Metals 61-66 spindlin 1 Homo sapiens 253-257 33405901-1 2021 The spin-forbidden nature of phosphorescence in Ir(III) complexes is relaxed by the metal-induced effect of spin-orbit coupling (SOC). Metals 84-89 spindlin 1 Homo sapiens 108-112 33216570-0 2020 Ultrafast Enhancement of Ferromagnetic Spin Exchange Induced by Ligand-to-Metal Charge Transfer. Metals 74-79 spindlin 1 Homo sapiens 39-43 33215496-0 2020 Role of Spin-Orbit Coupling in Long Range Energy Transfer in Metal-Organic Frameworks. Metals 61-66 spindlin 1 Homo sapiens 8-12 33156628-3 2020 Here we demonstrate by density functional theory calculations that precise spin manipulation can be achieved by extra CO and NO molecules coordination to transition metal phthalocyanine (TMPc) (TM = Co, Fe, Mn) molecules deposited on metal-supported graphene; the spins of TMPc molecules are switched from S to S - 1/2 ( S - 1 ) after NO (CO) coordination. Metals 165-170 spindlin 1 Homo sapiens 75-79 33112149-1 2020 Recent interest in transition-metal complexes as potential quantum bits (qubits) has reinvigorated the investigation of fundamental contributions to electron spin relaxation in various ligand scaffolds. Metals 30-35 spindlin 1 Homo sapiens 158-162 32961058-1 2020 Heisenberg exchange spin coupling between metal centers is essential for describing and understanding the electronic structure of many molecular catalysts, metalloenzymes, and molecular magnets for potential application in information technology. Metals 42-47 spindlin 1 Homo sapiens 20-24 33095016-0 2020 Long-Range Spin-Selective Transport in Chiral Metal-Organic Crystals with Temperature-Activated Magnetization. Metals 46-51 spindlin 1 Homo sapiens 11-15 33095016-1 2020 Room-temperature, long-range (300 nm), chirality-induced spin-selective electron conduction is found in chiral metal-organic Cu(II) phenylalanine crystals, using magnetic conductive-probe atomic force microscopy. Metals 111-116 spindlin 1 Homo sapiens 57-61 32955896-2 2020 Typically, a spin current is generated by a ferromagnetic (FM) or a heavy metal (HM) electrode in a nonlocal structure, which can be detected by another FM or HM electrode. Metals 74-79 spindlin 1 Homo sapiens 13-17 32428382-1 2020 The current craze for research around the spin crossover phenomenon can be justified to some extent by the mechanical properties due to the decrease of volume associated with the transition of the metal ion from the HS state to the LS state. Metals 197-202 spindlin 1 Homo sapiens 42-46 32776367-7 2020 The local spin configurations and orbital interactions in the benchmark transition-metal-based catalysts for OER and ORR are analyzed as examples. Metals 83-88 spindlin 1 Homo sapiens 10-14 32602710-1 2020 Incorporating chiral organic molecules into organic/inorganic hybrid 2D-layered metal-halide perovskites results in a novel family of chiral hybrid semiconductors with unique spin-dependent properties. Metals 80-85 spindlin 1 Homo sapiens 175-179 32574069-1 2020 Using circularly-polarised broadband transient absorption, time-resolved circular photoluminescence, and transient Faraday rotation spectroscopy, we report that spin-dependent interactions have a significant impact on exciton energies and spin depolarisation times in layered Ruddlesden-Popper hybrid metal-halide perovskites. Metals 301-306 spindlin 1 Homo sapiens 161-165 32699148-0 2020 Linear resistivity and Sachdev-Ye-Kitaev (SYK) spin liquid behavior in a quantum critical metal with spin-1/2 fermions. Metals 90-95 spindlin 1 Homo sapiens 101-109 32789172-4 2020 First, a strongly spin-polarized charge current is injected using highly spin-polarized hybridized states emerging at the complex ferromagnetic metal/molecule interfaces. Metals 144-149 spindlin 1 Homo sapiens 18-22 32789172-4 2020 First, a strongly spin-polarized charge current is injected using highly spin-polarized hybridized states emerging at the complex ferromagnetic metal/molecule interfaces. Metals 144-149 spindlin 1 Homo sapiens 73-77 32551620-3 2020 The spin-state of the porphyrin varies upon metal insertion, where Zn(II) is a diamagnetic metal, Cu(II) is paramagnetic, and Ni(II) can be switched from a diamagnetic square planar structure to a paramagnetic octahedral state by complexation with solvent (ie. Metals 44-49 spindlin 1 Homo sapiens 4-8 32551620-3 2020 The spin-state of the porphyrin varies upon metal insertion, where Zn(II) is a diamagnetic metal, Cu(II) is paramagnetic, and Ni(II) can be switched from a diamagnetic square planar structure to a paramagnetic octahedral state by complexation with solvent (ie. Metals 91-96 spindlin 1 Homo sapiens 4-8 32939272-0 2020 Spin-density studies of the multiferroic metal-organic compound [NH2(CH3)2][FeIIIFeII(HCOO)6]. Metals 41-46 spindlin 1 Homo sapiens 0-4 32681024-4 2020 Our theory shows that the interconversion owing to interfacial spin-orbit coupling at normal metal/ferromagnet interfaces can give rise to negative spin Hall magnetoresistance. Metals 93-98 spindlin 1 Homo sapiens 63-67 32681024-4 2020 Our theory shows that the interconversion owing to interfacial spin-orbit coupling at normal metal/ferromagnet interfaces can give rise to negative spin Hall magnetoresistance. Metals 93-98 spindlin 1 Homo sapiens 148-152 32555914-0 2020 More efficient spin-orbit coupling: adjusting the ligand field strength to the second metal ion in asymmetric binuclear platinum(ii) configurations. Metals 86-91 spindlin 1 Homo sapiens 15-19 32555914-4 2020 Pt-1 showed an enhanced spin-orbit coupling (SOC), caused by the additional metal component through direct orbital hybridization at higher states, where the fixed molecular skeleton induced by the additional metal-ligand bonding also helped to suppress molecular distortion in the excited state, ensuring a high quantum yield (Phi, 0.89 in toluene), which is among the best results in bimetallic complexes. Metals 76-81 spindlin 1 Homo sapiens 24-28 32576687-0 2020 Electronically driven spin-reorientation transition of the correlated polar metal Ca3Ru2O7. Metals 76-81 spindlin 1 Homo sapiens 22-26 32558573-1 2020 The voltage induced by the inverse spin Hall effect (ISHE) is affected by several factors, including the spin Hall angle of the normal metal (NM), the quality and magnetic properties of the ferromagnetic material (FM), and the interface conditions between the NM and FM bilayers in longitudinal spin Seebeck effect (LSSE) measurement. Metals 135-140 spindlin 1 Homo sapiens 35-39 32558573-1 2020 The voltage induced by the inverse spin Hall effect (ISHE) is affected by several factors, including the spin Hall angle of the normal metal (NM), the quality and magnetic properties of the ferromagnetic material (FM), and the interface conditions between the NM and FM bilayers in longitudinal spin Seebeck effect (LSSE) measurement. Metals 135-140 spindlin 1 Homo sapiens 105-109 32558573-1 2020 The voltage induced by the inverse spin Hall effect (ISHE) is affected by several factors, including the spin Hall angle of the normal metal (NM), the quality and magnetic properties of the ferromagnetic material (FM), and the interface conditions between the NM and FM bilayers in longitudinal spin Seebeck effect (LSSE) measurement. Metals 135-140 spindlin 1 Homo sapiens 105-109 32612163-1 2020 We present experimental data and their theoretical description on spin Hall magnetoresistance (SMR) in bilayers consisting of a heavy metal (H) coupled to in-plane magnetized ferromagnetic metal (F), and determine contributions to the magnetoresistance due to SMR and anisotropic magnetoresistance (AMR) in five different bilayer systems: [Formula: see text], [Formula: see text], [Formula: see text], W/Co, and Co/Pt. Metals 134-139 spindlin 1 Homo sapiens 66-70 32612163-1 2020 We present experimental data and their theoretical description on spin Hall magnetoresistance (SMR) in bilayers consisting of a heavy metal (H) coupled to in-plane magnetized ferromagnetic metal (F), and determine contributions to the magnetoresistance due to SMR and anisotropic magnetoresistance (AMR) in five different bilayer systems: [Formula: see text], [Formula: see text], [Formula: see text], W/Co, and Co/Pt. Metals 189-194 spindlin 1 Homo sapiens 66-70 32495785-0 2020 Influence of rare earth metal Ho on the interfacial Dzyaloshinskii-Moriya interaction and spin torque efficiency in Pt/Co/Ho multilayers. Metals 24-29 spindlin 1 Homo sapiens 90-94 32953030-1 2020 The incorporation of second-row transition metals into metal-organic frameworks could greatly improve the performance of these materials across a wide variety of applications due to the enhanced covalency, redox activity, and spin-orbit coupling of late-row metals relative to their first-row analogues. Metals 43-49 spindlin 1 Homo sapiens 226-230 32953030-1 2020 The incorporation of second-row transition metals into metal-organic frameworks could greatly improve the performance of these materials across a wide variety of applications due to the enhanced covalency, redox activity, and spin-orbit coupling of late-row metals relative to their first-row analogues. Metals 43-48 spindlin 1 Homo sapiens 226-230 32383584-1 2020 Here we report the first successful attempt to identify spin-crossover compounds in solutions of metal complexes produced by mixing different ligands and an appropriate metal salt by variable-temperature nuclear magnetic resonance (NMR) spectroscopy. Metals 97-102 spindlin 1 Homo sapiens 56-60 32486684-3 2020 To this end, we describe here a combined ligand field theory and multireference ab initio model to define spin-phonon coupling terms in S = 2 transition metal complexes and demonstrate how couplings originate from both the static and dynamic properties of ground and excited states. Metals 153-158 spindlin 1 Homo sapiens 106-110 32486684-6 2020 Furthermore, ratios between various intramolecular coupling terms for a given mode drive spin conversion processes in transition metal complexes and can be used to analyze the mechanisms of ISC. Metals 129-134 spindlin 1 Homo sapiens 89-93 32486684-8 2020 While the findings of this study are of general importance for understanding magnetization dynamics, they also link the phenomenon of spin-phonon coupling across fields of single molecule magnetism, quantum materials/qubits, and transition metal photophysics. Metals 240-245 spindlin 1 Homo sapiens 134-138 32790285-3 2020 Using scanning tunneling microscopy, spectroscopy and density functional theory calculations, we identify an antiferroelastic phase in the metal-organic chains, where the Ni atoms coordinated by deprotonated tetrahydroxybenzene linkers on Au(111) are at a low-spin (S = 0) or a high-spin (S = 1) state alternately along the chains. Metals 139-144 spindlin 1 Homo sapiens 260-264 32790285-3 2020 Using scanning tunneling microscopy, spectroscopy and density functional theory calculations, we identify an antiferroelastic phase in the metal-organic chains, where the Ni atoms coordinated by deprotonated tetrahydroxybenzene linkers on Au(111) are at a low-spin (S = 0) or a high-spin (S = 1) state alternately along the chains. Metals 139-144 spindlin 1 Homo sapiens 283-287 32495497-0 2020 A Mixed-Valence {Fe13} Cluster Exhibiting Metal-to-Metal Charge Transfer-Switched Spin Crossover. Metals 42-47 spindlin 1 Homo sapiens 82-86 32495497-0 2020 A Mixed-Valence {Fe13} Cluster Exhibiting Metal-to-Metal Charge Transfer-Switched Spin Crossover. Metals 51-56 spindlin 1 Homo sapiens 82-86 32495497-1 2020 It is promising and challenging to manipulate the electronic structures and functions of materials utilizing both metal-to-metal charge transfer (MMCT) and spin-crossover (SCO) to tune the valence and spin states of metal ions. Metals 114-119 spindlin 1 Homo sapiens 201-205 32495497-1 2020 It is promising and challenging to manipulate the electronic structures and functions of materials utilizing both metal-to-metal charge transfer (MMCT) and spin-crossover (SCO) to tune the valence and spin states of metal ions. Metals 123-128 spindlin 1 Homo sapiens 201-205 32495497-1 2020 It is promising and challenging to manipulate the electronic structures and functions of materials utilizing both metal-to-metal charge transfer (MMCT) and spin-crossover (SCO) to tune the valence and spin states of metal ions. Metals 123-128 spindlin 1 Homo sapiens 201-205 32841034-6 2020 A perpendicular magnetic field suppresses spin-flip scattering in the helical edges, resulting in a giant negative magnetoresistance (GNMR) up to 80% at 0.9 T. Comparison to theory indicates >96% of scattering is helical spin scattering significantly exceeding the maximum (67%) expected for a nonhelical metal. Metals 305-310 spindlin 1 Homo sapiens 42-46 32841034-6 2020 A perpendicular magnetic field suppresses spin-flip scattering in the helical edges, resulting in a giant negative magnetoresistance (GNMR) up to 80% at 0.9 T. Comparison to theory indicates >96% of scattering is helical spin scattering significantly exceeding the maximum (67%) expected for a nonhelical metal. Metals 305-310 spindlin 1 Homo sapiens 221-225 32643717-0 2020 Electrical conductivity and magnetic bistability in metal-organic frameworks and coordination polymers: charge transport and spin crossover at the nanoscale. Metals 52-57 spindlin 1 Homo sapiens 125-129 32667376-3 2020 To alleviate this symmetry breaking, the Extended Broken Symmetry (EBS) approach can be applied to complexes with an arbitrary number of local high-spin metal ions. Metals 153-158 spindlin 1 Homo sapiens 148-152 32673482-0 2020 Cooperative Large-Hysteresis Spin-Crossover Transition in the Iron(II) Triazolate [Fe(ta)2] Metal-Organic Framework. Metals 92-97 spindlin 1 Homo sapiens 29-33 32578990-0 2020 Probing Magnetism in Artificial Metal-Organic Complexes Using Electronic Spin Relaxometry. Metals 32-37 spindlin 1 Homo sapiens 73-77 32578990-2 2020 In order to engineer the spin"s properties, metal-organic frameworks provide a promising route which in turn requires thorough understanding of the metal-molecule interaction. Metals 44-49 spindlin 1 Homo sapiens 25-29 32578990-2 2020 In order to engineer the spin"s properties, metal-organic frameworks provide a promising route which in turn requires thorough understanding of the metal-molecule interaction. Metals 148-153 spindlin 1 Homo sapiens 25-29 32270586-7 2020 Our spiro compact dyad structure and the electron spin-control approach is different as compared to previous methods for which invoking transition-metal coordination or chromophores with intrinsic ISC ability is mandatory. Metals 147-152 spindlin 1 Homo sapiens 50-54 32486640-1 2020 We show by electron spin resonance (ESR) and Raman spectroscopies that the crystal phase transition of the lead-free double perovskite Cs2AgBiBr6 has a profound symmetry-breaking effect on the high-spin states of e.g. a transitional metal ion Fe3+ and the vibrational modes. Metals 233-238 spindlin 1 Homo sapiens 198-202 33209248-13 2020 Both the spin-state as well as spin-coupling between the two metal centres play a crucial role in dictating the reactivity for species 1. Metals 61-66 spindlin 1 Homo sapiens 9-13 33209248-13 2020 Both the spin-state as well as spin-coupling between the two metal centres play a crucial role in dictating the reactivity for species 1. Metals 61-66 spindlin 1 Homo sapiens 31-35 32301607-0 2020 Hofmann-Like Frameworks Fe(2-methylpyrazine)n[M(CN)2]2 (M = Au, Ag): Spin-Crossover Defined by the Precious Metal. Metals 108-113 spindlin 1 Homo sapiens 69-73 32301607-3 2020 In this paper, we report the synthesis and crystal structures of the metal-organic coordination polymers {FeII(Mepz)[AuI(CN)2]2} ([Au]) and {FeII(Mepz)2[AgI(CN)2]2} ([Ag]), where Mepz = 2-methylpyrazine, along with characterization of their spin-state behavior by variable-temperature SQUID magnetometry and Mossbauer spectroscopy. Metals 69-74 spindlin 1 Homo sapiens 241-245 32301210-1 2020 The thermally induced spin-crossover (SCO) phenomenon in transition metal complexes is an entropy-driven process, which has been extensively studied through calorimetric methods. Metals 68-73 spindlin 1 Homo sapiens 22-26 32403792-2 2020 One such force has been found to originate from the spin-orbit coupling of light, which produces a counter-intuitive lateral optical force on metal nanoparticles due to the spin of the electric-field components of light. Metals 142-147 spindlin 1 Homo sapiens 52-56 32403792-2 2020 One such force has been found to originate from the spin-orbit coupling of light, which produces a counter-intuitive lateral optical force on metal nanoparticles due to the spin of the electric-field components of light. Metals 142-147 spindlin 1 Homo sapiens 173-177 32320965-4 2020 Our study shows that strain can induce material phase changes from a bipolar magnetic semiconductor half metal magnetic metal in the nanoribbon, leading to interesting spin-resolved conductance with 100% spin filtering. Metals 107-112 spindlin 1 Homo sapiens 172-176 32320965-4 2020 Our study shows that strain can induce material phase changes from a bipolar magnetic semiconductor half metal magnetic metal in the nanoribbon, leading to interesting spin-resolved conductance with 100% spin filtering. Metals 107-112 spindlin 1 Homo sapiens 208-212 32320965-4 2020 Our study shows that strain can induce material phase changes from a bipolar magnetic semiconductor half metal magnetic metal in the nanoribbon, leading to interesting spin-resolved conductance with 100% spin filtering. Metals 124-129 spindlin 1 Homo sapiens 172-176 32320965-4 2020 Our study shows that strain can induce material phase changes from a bipolar magnetic semiconductor half metal magnetic metal in the nanoribbon, leading to interesting spin-resolved conductance with 100% spin filtering. Metals 124-129 spindlin 1 Homo sapiens 208-212 32281828-2 2020 In these systems spin reorientation occurs due to competing rare-earth and transition metal anisotropies coupled via f-d exchange. Metals 86-91 spindlin 1 Homo sapiens 17-21 32242729-0 2020 Spin and Charge Correlations across the Metal-to-Insulator Crossover in the Half-Filled 2D Hubbard Model. Metals 40-45 spindlin 1 Homo sapiens 0-4 31846105-1 2020 Spin-forbidden reactions are frequently encountered when first row transition metal-oxo species are involved. Metals 78-87 spindlin 1 Homo sapiens 0-4 31846105-12 2020 Using both approaches we provide here a systematic analysis of three prototypical transition metal-oxo spin-forbidden processes, involving Cr, Fe and Mn, to investigate their implications on reactivity. Metals 93-102 spindlin 1 Homo sapiens 103-107 31846105-13 2020 Results show that the spin-forbidden reactivity of first row transition metal-oxo species, where the spin-orbit coupling is relatively weak, can be safely described by a MECP approach. Metals 72-81 spindlin 1 Homo sapiens 22-26 31846105-13 2020 Results show that the spin-forbidden reactivity of first row transition metal-oxo species, where the spin-orbit coupling is relatively weak, can be safely described by a MECP approach. Metals 72-81 spindlin 1 Homo sapiens 101-105 32310644-0 2020 Correction to "Near-Infrared-to-Visible Photon Upconversion Sensitized by a Metal Complex with Spin-Forbidden yet Strong S0-T1 Absorption". Metals 76-81 spindlin 1 Homo sapiens 95-99 32096536-2 2020 The thermal spin crossover (SCO) phenomenon refers to an entropy-driven spin transition in some materials based on d6-d9 transition metal complexes. Metals 132-137 spindlin 1 Homo sapiens 12-16 32096536-2 2020 The thermal spin crossover (SCO) phenomenon refers to an entropy-driven spin transition in some materials based on d6-d9 transition metal complexes. Metals 132-137 spindlin 1 Homo sapiens 72-76 31381315-0 2019 Switching the Spin on a Ni Trimer within a Metal-Organic Motif by Controlling the On-Top Bromine Atom. Metals 43-48 spindlin 1 Homo sapiens 14-18 31538686-0 2019 Quantum Chemical Modeling of Pressure-Induced Spin Crossover in Octahedral Metal-Ligand Complexes. Metals 75-80 spindlin 1 Homo sapiens 46-50 31429575-0 2019 Realization of Spin-dependent Functionality by Covering a Metal Surface with a Single Layer of Molecules. Metals 58-63 spindlin 1 Homo sapiens 15-19 31429575-2 2019 Here, we demonstrate an efficient spin-to-charge current conversion at the metal surface covered by a single layer of molecules. Metals 75-80 spindlin 1 Homo sapiens 34-38 31429575-3 2019 Spin currents are injected into an interface between metal (Cu) and lead(II) phthalocyanine by means of the spin pumping method. Metals 53-58 spindlin 1 Homo sapiens 0-4 31429575-3 2019 Spin currents are injected into an interface between metal (Cu) and lead(II) phthalocyanine by means of the spin pumping method. Metals 53-58 spindlin 1 Homo sapiens 108-112 31865705-1 2020 Transition metal dichalcogenides (TMDCs) heterostructure with a type II alignment hosts unique interlayer excitons with the possibility of spin-triplet and spin-singlet states. Metals 11-32 spindlin 1 Homo sapiens 139-143 31865705-1 2020 Transition metal dichalcogenides (TMDCs) heterostructure with a type II alignment hosts unique interlayer excitons with the possibility of spin-triplet and spin-singlet states. Metals 11-32 spindlin 1 Homo sapiens 156-160 31823099-0 2019 Spin-column micro-solid phase extraction of chlorophenols using MFU-4l metal-organic framework. Metals 64-76 spindlin 1 Homo sapiens 0-4 31701004-3 2019 Although this finding opens a new field of metal-oxide spin-orbitronics, the role of the oxidation in the spin-orbit physics is still unclear. Metals 43-54 spindlin 1 Homo sapiens 55-59 31429583-0 2019 Spin-State Ordering in Metal-Based Compounds Using the Localized Active Space Self-Consistent Field Method. Metals 23-28 spindlin 1 Homo sapiens 0-4 31429583-1 2019 Quantitatively accurate calculations for spin-state ordering in transition-metal complexes typically demand a robust multiconfigurational treatment. Metals 75-80 spindlin 1 Homo sapiens 41-45 31294524-2 2019 A paradigmatic case is represented by open-shell metals supported on oxides, where the catalytic properties crucially depend on the nature of the metal-oxygen bonds and the extent of charge and spin transfer. Metals 49-54 spindlin 1 Homo sapiens 194-198 31294524-4 2019 We show that just a few selected sites out of all possible are populated and that the relative occupancies depend on the specific properties of the metal, and we provide maps of charge and spin transfer at the metal-oxygen interface. Metals 148-153 spindlin 1 Homo sapiens 189-193 31294524-4 2019 We show that just a few selected sites out of all possible are populated and that the relative occupancies depend on the specific properties of the metal, and we provide maps of charge and spin transfer at the metal-oxygen interface. Metals 210-215 spindlin 1 Homo sapiens 189-193 30982799-0 2019 Stability Enhancement of 129Xe Hyperpolarizing System Using Alkali Metal Vapor in Spin-Exchange Optical Pumping Cell to Achieve High NMR Sensitivity. Metals 67-72 spindlin 1 Homo sapiens 82-86 31381315-1 2019 Controlling the spin of metal atoms embedded in molecular systems is a key step toward the realization of molecular electronics and spintronics. Metals 24-29 spindlin 1 Homo sapiens 16-20 31381315-2 2019 Many efforts have been devoted to explore the influencing factors dictating the survival or quenching of a magnetic moment in a metal-organic molecule, and among others, the spin control by axial ligand attachments is the most promising. Metals 128-133 spindlin 1 Homo sapiens 174-178 31381315-3 2019 Herein, from the interplay of high-resolution scanning tunneling microscopy imaging/manipulation and scanning tunneling spectroscopy measurements together with density functional theory calculations, we successfully demonstrate that a Ni trimer within a metal-organic motif acquires a net spin promoted by the adsorption of an on-top Br atom. Metals 254-259 spindlin 1 Homo sapiens 289-293 31125219-3 2019 CD and CPL properties are calculated ab initio for the spin-forbidden transitions of both a transition metal and a lanthanide complex. Metals 103-108 spindlin 1 Homo sapiens 55-59 31180665-0 2019 Triphenylene-Bridged Trinuclear Complexes of Cu: Models for Spin Interactions in Two-Dimensional Electrically Conductive Metal-Organic Frameworks. Metals 121-126 spindlin 1 Homo sapiens 60-64 31180665-2 2019 These trinuclear complexes are molecular models for spin exchange interactions in the two-dimensional conductive metal-organic frameworks (MOFs) copper hexaoxytriphenylene (Cu3HOTP2) and copper hexaiminotriphenylene (Cu3HITP2). Metals 113-118 spindlin 1 Homo sapiens 52-56 31241335-5 2019 The data show the typical average Fe-ligand bond length elongation of ~0.18 A for a 5T2 state and suggest a high anisotropy of the primary coordination sphere around the metal center in the excited 5T2 state, in stark contrast to the nearly perfect octahedral symmetry that characterizes the low-spin 1A1 ground state structure. Metals 170-175 spindlin 1 Homo sapiens 296-300 30855953-4 2019 Our extensive study reveals several factors that affect the spin ground state: (1) (formal) Mn oxidation state; (2) metal-ligand covalency; (3) coordination geometry; and (4) structural change of the Mn cluster induced by alternations in Mn Mn distances. Metals 116-121 spindlin 1 Homo sapiens 60-64 31046294-3 2019 Through quantification of its spin current by the SOT exerted on an adjacent Co ferromagnetic layer, we determine that SrRuO3 has a strongly temperature ( T)-dependent spin Hall conductivity sigma SH, increasing with the electrical conductivity, consistent with expected behavior of the intrinsic effect in the "dirty metal" regime. Metals 318-323 spindlin 1 Homo sapiens 168-172 30855953-6 2019 We found that the high spin state ( Stotal = 6) of the oxyl-oxo species can be causative for catalytic function, which manifests through mixing of the metal-ligand character in magnetic orbitals at relatively short O5 O6 distances (<2.0 A) and long MnA O5 distances (>2.0 A). Metals 151-156 spindlin 1 Homo sapiens 23-27 30560666-1 2019 Single chains of metal atoms are expected to be perfect one-dimensional nanowires in nanotechnology, due to their quantum nature including tunable electronic or spin coupling strengths. Metals 17-22 spindlin 1 Homo sapiens 161-165 30823580-0 2019 Linear Response Functions of Densities and Spin Densities for Systematic Modeling of the QM/MM Approach for Mono- and Poly-Nuclear Transition Metal Systems. Metals 142-147 spindlin 1 Homo sapiens 43-47 30823580-1 2019 We applied our analysis, based on a linear response function of density and spin density, to two typical transition metal complex systems-the reaction centers of P450, and oxygen evolving center in Photosystem II, both of which contain open-shell transition metal ions. Metals 116-121 spindlin 1 Homo sapiens 76-80 30848626-0 2019 Spin-Orbit Torques in Heavy-Metal-Ferromagnet Bilayers with Varying Strengths of Interfacial Spin-Orbit Coupling. Metals 28-33 spindlin 1 Homo sapiens 0-4 30848626-0 2019 Spin-Orbit Torques in Heavy-Metal-Ferromagnet Bilayers with Varying Strengths of Interfacial Spin-Orbit Coupling. Metals 28-33 spindlin 1 Homo sapiens 93-97 30848626-1 2019 Despite intense efforts it has remained unresolved whether and how interfacial spin-orbit coupling (ISOC) affects spin transport across heavy-metal (HM)-ferromagnet (FM) interfaces. Metals 142-147 spindlin 1 Homo sapiens 79-83 31012640-0 2019 Generation and Detection of Pure Spin Current in an H-Shaped Structure of a Single Metal. Metals 83-88 spindlin 1 Homo sapiens 33-37 30817155-1 2019 By combining a pulsed laser ablation vanadium atom (V) beam source with the two-color laser sequential electric field pulse scheme for pulse field ionization-photoion (PFI-PI) detection, we have developed a quantum spin-orbit state selected transition metal ion source for ion-molecule reaction studies. Metals 252-257 spindlin 1 Homo sapiens 215-219 30422385-0 2019 Spin in a Closed-Shell Organic Molecule on a Metal Substrate Generated by a Sigmatropic Reaction. Metals 45-50 spindlin 1 Homo sapiens 0-4 30422385-1 2019 Inert metal surfaces present more chances of hosting organic intact radicals than other substrates, but large amounts of delocalized electronic states favor charge transfer and thus spin quenching. Metals 6-11 spindlin 1 Homo sapiens 182-186 30472859-0 2019 Evidence of Pure Spin-Current Generated by Spin Pumping in Interface-Localized States in Hybrid Metal-Silicon-Metal Vertical Structures. Metals 96-101 spindlin 1 Homo sapiens 17-21 30472859-0 2019 Evidence of Pure Spin-Current Generated by Spin Pumping in Interface-Localized States in Hybrid Metal-Silicon-Metal Vertical Structures. Metals 96-101 spindlin 1 Homo sapiens 43-47 30472859-0 2019 Evidence of Pure Spin-Current Generated by Spin Pumping in Interface-Localized States in Hybrid Metal-Silicon-Metal Vertical Structures. Metals 110-115 spindlin 1 Homo sapiens 17-21 30472859-0 2019 Evidence of Pure Spin-Current Generated by Spin Pumping in Interface-Localized States in Hybrid Metal-Silicon-Metal Vertical Structures. Metals 110-115 spindlin 1 Homo sapiens 43-47 30636126-4 2018 The present results demonstrate the remarkable impact of spin-dependent electron correlation effects originating from single-particle excitations in a prototypical 3d transition metal, paving the way for further refinement of current many-body theoretical approaches. Metals 178-183 spindlin 1 Homo sapiens 57-61 30467570-0 2018 Spin-orbit coupling prevents spin channel suppression of transition metal atoms on armchair graphene nanoribbons. Metals 68-73 spindlin 1 Homo sapiens 0-4 30467570-0 2018 Spin-orbit coupling prevents spin channel suppression of transition metal atoms on armchair graphene nanoribbons. Metals 68-73 spindlin 1 Homo sapiens 29-33 30222354-2 2018 Paramagnetic metal ions, such as Cu2+, are used as spin probes because they can report on metalloprotein features and can be spectroscopically distinguished from traditional nitroxide (NO)-based labels. Metals 13-18 spindlin 1 Homo sapiens 51-55 30362761-1 2018 The interplay between Mn ions and corrole ligands gives rise to complex scenarios regarding the metal centers" electronic properties expressing a range of high oxidation states and spin configurations. Metals 96-101 spindlin 1 Homo sapiens 181-185 30387652-3 2018 Here, we propose spin-resolved transport in a junction between a normal metal and a spin-orbit coupled nodal-line semimetal as the mechanism for their detection. Metals 72-77 spindlin 1 Homo sapiens 17-21 30387652-3 2018 Here, we propose spin-resolved transport in a junction between a normal metal and a spin-orbit coupled nodal-line semimetal as the mechanism for their detection. Metals 72-77 spindlin 1 Homo sapiens 84-88 30292195-0 2018 Spin-polarized and thermospin-polarized transport properties of phthalocyanine dimer based molecular junction with different transition metal atoms. Metals 136-141 spindlin 1 Homo sapiens 0-4 29697132-3 2018 Furthermore, redox or spin-crossover processes can result in the simultaneous presence of metal centres in different oxidation or spin states. Metals 90-95 spindlin 1 Homo sapiens 22-26 30145887-0 2018 Scaling Up Electronic Spin Qubits into a Three-Dimensional Metal-Organic Framework. Metals 59-64 spindlin 1 Homo sapiens 22-26 30062762-0 2018 Construction of a Metal-Free Electron Spin System by Encapsulation of an NO Molecule Inside an Open-Cage Fullerene C60 Derivative. Metals 18-23 spindlin 1 Homo sapiens 38-42 30186827-6 2018 The spin-transition phenomenon also affects the optical properties, with significant decrease of the intensity of the Metal-to-Ligand charge transfer band upon increasing the temperature. Metals 118-123 spindlin 1 Homo sapiens 4-8 29944837-10 2018 By underlining a rather subtle interplay between the solvation and correlation effects, the findings of this Article are relevant not only for modeling and interpretation of optical spectra of transition metal complexes but also in further benchmarking of theoretical methods for the challenging problem of spin-state energetics. Metals 204-209 spindlin 1 Homo sapiens 307-311 29941625-2 2018 If the normal metal is replaced by a ferromagnetic material, the spatial extent of the proximity effect drops precipitously due to the exchange splitting between the majority and minority spin bands in the ferromagnet. Metals 14-19 spindlin 1 Homo sapiens 188-192 30042421-4 2018 Upon exciting the metal with an infrared laser pulse, a spin Seebeck current js arises on the same ~100 fs time scale on which the metal electrons thermalize. Metals 131-136 spindlin 1 Homo sapiens 56-60 30042421-5 2018 This observation highlights that efficient spin transfer critically relies on carrier multiplication and is driven by conduction electrons scattering off the metal-insulator interface. Metals 158-163 spindlin 1 Homo sapiens 43-47 29968702-0 2018 Spin-phonon couplings in transition metal complexes with slow magnetic relaxation. Metals 36-41 spindlin 1 Homo sapiens 0-4 29968702-8 2018 This work spectroscopically reveals and quantitates the spin-phonon couplings in typical transition metal complexes and sheds light on the origin of the spin-phonon entanglement. Metals 100-105 spindlin 1 Homo sapiens 56-60 29968702-8 2018 This work spectroscopically reveals and quantitates the spin-phonon couplings in typical transition metal complexes and sheds light on the origin of the spin-phonon entanglement. Metals 100-105 spindlin 1 Homo sapiens 153-157 30004749-0 2018 Erratum: Ultrafast Spin-State Dynamics in Transition-Metal Complexes Triggered by Soft-X-Ray Light [Phys. Metals 53-58 spindlin 1 Homo sapiens 19-23 30042421-4 2018 Upon exciting the metal with an infrared laser pulse, a spin Seebeck current js arises on the same ~100 fs time scale on which the metal electrons thermalize. Metals 18-23 spindlin 1 Homo sapiens 56-60 29697132-3 2018 Furthermore, redox or spin-crossover processes can result in the simultaneous presence of metal centres in different oxidation or spin states. Metals 90-95 spindlin 1 Homo sapiens 130-134 29614218-0 2018 Toward Highly Accurate Spin State Energetics in First-Row Transition Metal Complexes: A Combined CASPT2/CC Approach. Metals 69-74 spindlin 1 Homo sapiens 23-27 29802380-5 2018 Our method takes advantage of the large spin Hall angle of transition metal beta-W, so that the critical switching current density is only on the order of 106A/cm2 in the absence of magnetic field. Metals 70-75 spindlin 1 Homo sapiens 40-44 29696280-4 2018 In this review, we present the theoretical framework and the experiments performed to detect and characterize the spin-orbit coupling and spin currents in graphene/transition metal dichalcogenide heterostructures. Metals 175-180 spindlin 1 Homo sapiens 114-118 29696280-4 2018 In this review, we present the theoretical framework and the experiments performed to detect and characterize the spin-orbit coupling and spin currents in graphene/transition metal dichalcogenide heterostructures. Metals 175-180 spindlin 1 Homo sapiens 138-142 29756816-1 2018 Motivated by recent experimental work, we consider spin transport between a normal metal and a gapped quantum paramagnet. Metals 83-88 spindlin 1 Homo sapiens 51-55 29489330-1 2018 The oxidation and spin state of a metal-organic molecule determine its chemical reactivity and magnetic properties. Metals 34-39 spindlin 1 Homo sapiens 18-22 29618210-1 2018 The interaction of low-energy photoelectrons with well-ordered monolayers of enantiopure helical heptahelicene molecules adsorbed on metal surfaces leads to a preferential transmission of one longitudinally polarized spin component, which is strongly coupled to the helical sense of the molecules. Metals 133-138 spindlin 1 Homo sapiens 217-221 29112322-0 2018 Ab Initio Ligand Field Molecular Mechanics and the Nature of Metal-Ligand pi-Bonding in Fe(II) 2,6-di(pyrazol-1-yl)pyridine Spin Crossover Complexes. Metals 61-66 spindlin 1 Homo sapiens 124-128 29143986-1 2018 The second-order spin-orbit coupling is evaluated in two transition-metal complexes to establish the effect on the deactivation mechanism of the excited low-spin state in systems that undergo spin transitions under the influence of light. Metals 68-73 spindlin 1 Homo sapiens 17-21 29143986-1 2018 The second-order spin-orbit coupling is evaluated in two transition-metal complexes to establish the effect on the deactivation mechanism of the excited low-spin state in systems that undergo spin transitions under the influence of light. Metals 68-73 spindlin 1 Homo sapiens 157-161 29143986-1 2018 The second-order spin-orbit coupling is evaluated in two transition-metal complexes to establish the effect on the deactivation mechanism of the excited low-spin state in systems that undergo spin transitions under the influence of light. Metals 68-73 spindlin 1 Homo sapiens 157-161 29143986-4 2018 This opens the possibility of a direct deactivation from the singlet and triplet states of the metal-to-ligand charge-transfer manifold to the final high-spin state as suggested from the interpretation of experimental data but so far not supported by theoretical descriptions of the light-induced spin crossover. Metals 95-100 spindlin 1 Homo sapiens 154-158 29143986-4 2018 This opens the possibility of a direct deactivation from the singlet and triplet states of the metal-to-ligand charge-transfer manifold to the final high-spin state as suggested from the interpretation of experimental data but so far not supported by theoretical descriptions of the light-induced spin crossover. Metals 95-100 spindlin 1 Homo sapiens 297-301 29614218-1 2018 In previous work on the performance of multiconfigurational second-order perturbation theory (CASPT2) in describing spin state energetics in first-row transition metal systems [ Pierloot et al. Metals 162-167 spindlin 1 Homo sapiens 116-120 29376389-2 2018 We provide a consistent mapping of noncollinear two-component quasirelativistic DFT energies with appropriate orientations of localized spinor quantization axes for multinuclear exchange-coupled transition-metal complexes onto an uncoupled anisotropic effective spin Hamiltonian. Metals 206-211 spindlin 1 Homo sapiens 136-140 29466854-0 2018 Long Spin-Relaxation Times in a Transition-Metal Atom in Direct Contact to a Metal Substrate. Metals 43-48 spindlin 1 Homo sapiens 5-9 29466854-0 2018 Long Spin-Relaxation Times in a Transition-Metal Atom in Direct Contact to a Metal Substrate. Metals 77-82 spindlin 1 Homo sapiens 5-9 29466854-2 2018 An atomic-scale solid-state realization of such a system is the spin of a transition-metal atom adsorbed on a suitable substrate. Metals 85-90 spindlin 1 Homo sapiens 64-68 29466854-4 2018 Here, we show that the spin states of iron atoms adsorbed directly on a conductive platinum substrate have a surprisingly long spin-relaxation time in the nanosecond regime, which is comparable to that of a transition metal atom decoupled from the substrate electrons by a thin decoupling layer. Metals 218-223 spindlin 1 Homo sapiens 23-27 29547325-1 2018 Robust spin Hall effects (SHE) have recently been observed in nonmagnetic heavy metal systems with strong spin-orbit interactions. Metals 80-85 spindlin 1 Homo sapiens 7-11 29547325-1 2018 Robust spin Hall effects (SHE) have recently been observed in nonmagnetic heavy metal systems with strong spin-orbit interactions. Metals 80-85 spindlin 1 Homo sapiens 106-110 29393070-7 2018 Our findings suggest the possibility to tune the spin exchange across the interface between a ferromagnetic metal and a topological insulator through the number of intervening hBN layers. Metals 108-113 spindlin 1 Homo sapiens 49-53 29955244-1 2018 Simultaneous reversible chemical exchange of parahydrogen and to-be-hyperpolarized substrate on metal centers enables spontaneous transfer of spin order from parahydrogen singlet to nuclear spins of the substrate. Metals 96-101 spindlin 1 Homo sapiens 142-146 29431837-1 2018 The accurate description of transition metal complexes in liquid solutions is a challenging fundamental research problem, which must be tackled when it comes to understanding the role of the solvent in the photoinduced low-spin (LS) high-spin (HS) transition in solvated Fe(ii) complexes. Metals 39-44 spindlin 1 Homo sapiens 223-227 29431837-1 2018 The accurate description of transition metal complexes in liquid solutions is a challenging fundamental research problem, which must be tackled when it comes to understanding the role of the solvent in the photoinduced low-spin (LS) high-spin (HS) transition in solvated Fe(ii) complexes. Metals 39-44 spindlin 1 Homo sapiens 240-244 29359566-2 2018 Spin currents are triggered through the spin Seebeck effect, either by a continuous (dc) temperature gradient or by ultrafast optical heating of the metal layer. Metals 149-154 spindlin 1 Homo sapiens 0-4 29359566-2 2018 Spin currents are triggered through the spin Seebeck effect, either by a continuous (dc) temperature gradient or by ultrafast optical heating of the metal layer. Metals 149-154 spindlin 1 Homo sapiens 40-44 29049878-0 2017 Unifying Exchange Sensitivity in Transition-Metal Spin-State Ordering and Catalysis through Bond Valence Metrics. Metals 44-49 spindlin 1 Homo sapiens 50-54 29219525-4 2017 The results establish that the gradual spin-state crossover is associated with a relative change of Coulomb energy versus bandwidth, leading to a Mott-type insulator-to-metal transition. Metals 169-174 spindlin 1 Homo sapiens 39-43 29272584-3 2018 Dimetallic aza[80]fullerenes M2@C79N (M = Y or Gd) possess an unpaired electron located between two metal ions, offering an opportunity to manipulate spin(s) protected in the cage for quantum information processing. Metals 2-7 spindlin 1 Homo sapiens 150-154 29400496-1 2018 We theoretically investigate the fluctuation of a pure spin current induced by the spin Seebeck effect and spin pumping in a normal-metal-(NM-)ferromagnet(FM) bilayer system. Metals 132-137 spindlin 1 Homo sapiens 55-59 29219336-1 2017 We report on fundamental aspects of spin dynamics in heterostructures of graphene and transition metal dichalcogenides (TMDCs). Metals 97-102 spindlin 1 Homo sapiens 36-40 29123123-3 2017 Here, we report spin Nernst effect-induced transverse magnetoresistance in ferromagnet/non-magnetic heavy metal bilayers. Metals 106-111 spindlin 1 Homo sapiens 16-20 29123123-5 2017 This strong dependence of transverse magnetoresistance on heavy metal evidences the generation of thermally induced pure spin current in heavy metal. Metals 64-69 spindlin 1 Homo sapiens 121-125 29123123-5 2017 This strong dependence of transverse magnetoresistance on heavy metal evidences the generation of thermally induced pure spin current in heavy metal. Metals 143-148 spindlin 1 Homo sapiens 121-125 29064659-0 2017 Cobalt(II) Magnetic Metal-Organic Framework with an Effective Kagome Lattice, Large Surface Area, and High Spin-Canted Ordering Temperature. Metals 20-25 spindlin 1 Homo sapiens 107-111 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 85-90 spindlin 1 Homo sapiens 133-137 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 85-90 spindlin 1 Homo sapiens 133-137 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 85-90 spindlin 1 Homo sapiens 133-137 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 362-367 spindlin 1 Homo sapiens 51-55 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 362-367 spindlin 1 Homo sapiens 133-137 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 362-367 spindlin 1 Homo sapiens 133-137 28970474-6 2017 The present results substantiate the desired doped spin liquid and suggest a strange metal, in which the coherence of the underlying spin liquid promotes the deconfinement of charge from the layers while preserving the non-Fermi-liquid nature.It is expected that introducing charge carriers into an exotic quantum spin liquid state may lead to an unconventional metal but there are no clear realizations of a metallic spin liquid. Metals 362-367 spindlin 1 Homo sapiens 133-137 28970474-7 2017 Here, the authors present a spin liquid candidate that also shows evidence of strange metal behavior. Metals 86-91 spindlin 1 Homo sapiens 28-32 28722688-3 2017 Interestingly, a metal to semiconductor transition occurs as the number of the superlattice for a crossed superlattice p-n junction increases, and its spin Seebeck coefficient is much larger than that for the T-shaped one around the zero Fermi energy. Metals 17-22 spindlin 1 Homo sapiens 151-155 28872317-2 2017 Here, we create spin chains in which a strongly correlated Kondo state emerges from magnetic coupling of transition-metal atoms. Metals 116-121 spindlin 1 Homo sapiens 16-20 29049878-1 2017 Accurate predictions of spin-state ordering, reaction energetics, and barrier heights are critical for the computational discovery of open-shell transition-metal (TM) catalysts. Metals 156-161 spindlin 1 Homo sapiens 24-28 29049878-6 2017 We rationalize trends in both reaction and spin energetics by introducing a measure of delocalization, the bond valence of the metal-ligand bonds in each complex. Metals 127-132 spindlin 1 Homo sapiens 43-47 28949193-7 2017 Case (ii), referred to as "a spin-valley half-metal," corresponds to complete polarization with respect to the spin-valley operator. Metals 46-51 spindlin 1 Homo sapiens 29-33 29104916-3 2017 Water-soluble and biocompatible metal complexes with a significant degree of spin-orbit coupling were identified as target candidates for testing our new hypothesis. Metals 32-37 spindlin 1 Homo sapiens 77-81 28949193-7 2017 Case (ii), referred to as "a spin-valley half-metal," corresponds to complete polarization with respect to the spin-valley operator. Metals 46-51 spindlin 1 Homo sapiens 111-115 28834001-0 2017 Corrigendum: Spectroscopic Capture and Reactivity of a Low-Spin Cobalt(IV)-Oxo Complex Stabilized by Binding Redox-Inactive Metal Ions. Metals 124-129 spindlin 1 Homo sapiens 59-63 28949675-6 2017 As an example, we apply this general theory to inhomogeneous surface plasmon-polariton (SPP) waves at a metal-vacuum interface and show that SPPs carry a "supermomentum," proportional to the wave vector k_{p}>omega/c, and a transverse spin, which can change its sign depending on the frequency omega. Metals 104-109 spindlin 1 Homo sapiens 238-242 28682632-0 2017 Linking the Character of the Metal-Ligand Bond to the Ligand NMR Shielding in Transition-Metal Complexes: NMR Contributions from Spin-Orbit Coupling. Metals 29-34 spindlin 1 Homo sapiens 129-133 28745744-3 2017 The best catalysts show metal sites with localized spins and electron delocalization; a correlation exists between the rate constant for charge transfer reactions and spin-dependent electron mobility. Metals 24-29 spindlin 1 Homo sapiens 51-55 28949746-7 2017 Furthermore, the spin Seebeck coefficient is finite even at zero magnetic field, provided that the normal metal contacts break the symmetry between the antiferromagnetic sublattices. Metals 106-111 spindlin 1 Homo sapiens 17-21 28593650-1 2017 The electrocatalytic activity of transition-metal-based compounds is strongly related to the spin states of metal atoms. Metals 44-49 spindlin 1 Homo sapiens 93-97 28593650-1 2017 The electrocatalytic activity of transition-metal-based compounds is strongly related to the spin states of metal atoms. Metals 108-113 spindlin 1 Homo sapiens 93-97 28593650-6 2017 This work establishes new way for the design of advanced electrocatalysts in transition-metal-based compounds via regulation of spin states. Metals 88-93 spindlin 1 Homo sapiens 128-132 28338246-0 2017 Insights into trans-Ligand and Spin-Orbit Effects on Electronic Structure and Ligand NMR Shifts in Transition-Metal Complexes. Metals 110-115 spindlin 1 Homo sapiens 31-35 28682632-0 2017 Linking the Character of the Metal-Ligand Bond to the Ligand NMR Shielding in Transition-Metal Complexes: NMR Contributions from Spin-Orbit Coupling. Metals 89-94 spindlin 1 Homo sapiens 129-133 28682632-4 2017 We show how the paramagnetic NMR shielding and spin-orbit effects relate to the character of the metal-ligand (M-L) bond. Metals 97-102 spindlin 1 Homo sapiens 47-51 28248100-5 2017 Pumping at 530 nm leads to ultrafast nonradiative relaxation from the singlet metal-to-ligand charge transfer (1MLCT) excited state into a quintet metal centered state (5MC) as has been observed for prototypical low-spin Fe(II) polypyridine complexes such as [Fe(tpy)2]2+. Metals 78-83 spindlin 1 Homo sapiens 216-220 28557422-0 2017 Guest Induced Strong Cooperative One- and Two-Step Spin Transitions in Highly Porous Iron(II) Hofmann-Type Metal-Organic Frameworks. Metals 107-112 spindlin 1 Homo sapiens 51-55 28557422-1 2017 The synthesis, crystal structure, magnetic, calorimetric, and Mossbauer studies of a series of new Hofmann-type spin crossover (SCO) metal-organic frameworks (MOFs) is reported. Metals 133-138 spindlin 1 Homo sapiens 112-116 28489392-9 2017 Essentially, the charge transfer and spin flip originate from the discontinuous changes of metal-oxygen bond lengths and angles in the compressed atomic structure. Metals 91-96 spindlin 1 Homo sapiens 37-41 28581806-3 2017 This transition is reversible by an external magnetic field of 3 T. Tailored exchange interactions between rare-earth and transition-metal ions thus open up new perspectives for the manipulation of spin structures in metal-oxide heterostructures and devices. Metals 133-138 spindlin 1 Homo sapiens 198-202 28581806-3 2017 This transition is reversible by an external magnetic field of 3 T. Tailored exchange interactions between rare-earth and transition-metal ions thus open up new perspectives for the manipulation of spin structures in metal-oxide heterostructures and devices. Metals 217-222 spindlin 1 Homo sapiens 198-202 28145286-4 2017 We use these equations to address the nature of the spin transfer torque in (i) a spin-valve composed of a ferromagnet and an antiferromagnet, (ii) a metallic bilayer consisting of an antiferromagnet adjacent to a heavy metal possessing spin Hall effect, and in (iii) a single antiferromagnet possessing spin Hall effect. Metals 150-155 spindlin 1 Homo sapiens 52-56 28262877-0 2017 Spin splitting and reemergence of charge compensation in monolayer WTe2 by 3d transition-metal adsorption. Metals 89-94 spindlin 1 Homo sapiens 0-4 28696755-2 2017 In thin bilayer systems consisting of a nonmagnetic metal and a ferromagnet, a pure spin current is induced by a precessing magnetization into the nonmagnetic layer by spin pumping. Metals 52-57 spindlin 1 Homo sapiens 84-88 28696755-2 2017 In thin bilayer systems consisting of a nonmagnetic metal and a ferromagnet, a pure spin current is induced by a precessing magnetization into the nonmagnetic layer by spin pumping. Metals 52-57 spindlin 1 Homo sapiens 168-172 28534400-3 2017 In contrast, spin/valley polarization can be efficiently generated in monolayer transition metal dichalcogenides (TMD) such as MoS2 via absorption of circularly polarized photons, but lateral spin or valley transport has not been realized at room temperature. Metals 91-96 spindlin 1 Homo sapiens 13-17 28266859-0 2017 Spin-Orbit Coupling Drives Femtosecond Nonadiabatic Dynamics in a Transition Metal Compound. Metals 77-82 spindlin 1 Homo sapiens 0-4 28176869-3 2017 The model is relevant for a number of molecular magnets with triangular motifs consisting of transition metal ions such as Cr, Cu and V. Re-entrant spin-state behavior and chirality on-off transitions exist over a wide parameter regime. Metals 104-109 spindlin 1 Homo sapiens 148-152 27989152-0 2016 Metal-Insulator Transition Induced by Spin Reorientation in Fe7Se8 Grain Boundaries. Metals 0-5 spindlin 1 Homo sapiens 38-42 27859663-3 2017 For example, there is still no clear understanding of major spin-flip mechanisms in organic semiconductors and the role of hybrid metal-organic interfaces in spin injection. Metals 130-135 spindlin 1 Homo sapiens 158-162 27859663-5 2017 Additionally, modification of the band energetics, morphology, and even spin magnetic moment at the metal-organic interface by interface engineering can greatly impact the efficiency of spin-polarized carrier injection. Metals 100-105 spindlin 1 Homo sapiens 72-76 27859663-5 2017 Additionally, modification of the band energetics, morphology, and even spin magnetic moment at the metal-organic interface by interface engineering can greatly impact the efficiency of spin-polarized carrier injection. Metals 100-105 spindlin 1 Homo sapiens 186-190 27960524-0 2016 Strong Rashba-Edelstein Effect-Induced Spin-Orbit Torques in Monolayer Transition Metal Dichalcogenide/Ferromagnet Bilayers. Metals 82-87 spindlin 1 Homo sapiens 39-43 27941810-2 2016 Metal-organic molecules, in particular, let the spin state of the core metal ion to be modified according to its organic environment, allowing localized magnetic moments to emerge as functional entities with radically different properties from its simple atomic counterparts. Metals 0-5 spindlin 1 Homo sapiens 48-52 27941810-2 2016 Metal-organic molecules, in particular, let the spin state of the core metal ion to be modified according to its organic environment, allowing localized magnetic moments to emerge as functional entities with radically different properties from its simple atomic counterparts. Metals 71-76 spindlin 1 Homo sapiens 48-52 27989152-5 2016 We observe an interesting metal-insulator transition at the same temperature as the spin-direction changes. Metals 26-31 spindlin 1 Homo sapiens 84-88 27841408-0 2016 Thermoelectricity in transition metal compounds: the role of spin disorder. Metals 32-37 spindlin 1 Homo sapiens 61-65 27869213-1 2016 An all-metal lateral spin-valve structure has been fabricated with a medial Copper nano-ring to split the diffusive spin-current path. Metals 7-12 spindlin 1 Homo sapiens 21-25 27869213-1 2016 An all-metal lateral spin-valve structure has been fabricated with a medial Copper nano-ring to split the diffusive spin-current path. Metals 7-12 spindlin 1 Homo sapiens 116-120 27911535-1 2016 The magnitude of spin-orbit torque (SOT), exerted to a ferromagnet (FM) from an adjacent heavy metal (HM), strongly depends on the amount of spin current absorbed in the FM. Metals 95-100 spindlin 1 Homo sapiens 17-21 27911535-1 2016 The magnitude of spin-orbit torque (SOT), exerted to a ferromagnet (FM) from an adjacent heavy metal (HM), strongly depends on the amount of spin current absorbed in the FM. Metals 95-100 spindlin 1 Homo sapiens 141-145 27792373-4 2016 We find similar spin-dependent trajectories of light induced by a strong SOI also in the near field of surface plasmons generated on the tip of a metal nanowire. Metals 146-151 spindlin 1 Homo sapiens 16-20 27606799-0 2016 Spin-Adapted Formulation and Implementation of Density Cumulant Functional Theory with Density-Fitting Approximation: Application to Transition Metal Compounds. Metals 144-149 spindlin 1 Homo sapiens 0-4 27529311-0 2016 How to Switch Spin-Crossover Metal Complexes at Constant Room Temperature. Metals 29-34 spindlin 1 Homo sapiens 14-18 27529311-1 2016 Spin-crossover metal complexes represent a highly promising class of molecular switches, the diverse physicochemical properties of which can be reversibly changed by different physical and chemical stimuli. Metals 15-20 spindlin 1 Homo sapiens 0-4 27529311-4 2016 This Concept article provides an overview about how the switching of spin-crossover metal complexes can be achieved at constant room temperature. Metals 84-89 spindlin 1 Homo sapiens 69-73 27725654-4 2016 Here we show that the spin Hall effect in Cu, a light metal with weak spin-orbit coupling, is significantly enhanced through natural oxidation. Metals 54-59 spindlin 1 Homo sapiens 22-26 27782628-0 2016 Geometries of low spin states of multi-centre transition metal complexes through extended broken symmetry variational Monte Carlo. Metals 57-62 spindlin 1 Homo sapiens 18-22 27650796-1 2016 Molecular quantum magnetism involving an isolated spin state is of particular interest due to the characteristic quantum phenomena underlying spin qubits or molecular spintronics for quantum information devices, as demonstrated in magnetic metal-organic molecular systems, the so-called molecular magnets. Metals 240-245 spindlin 1 Homo sapiens 50-54 27650796-1 2016 Molecular quantum magnetism involving an isolated spin state is of particular interest due to the characteristic quantum phenomena underlying spin qubits or molecular spintronics for quantum information devices, as demonstrated in magnetic metal-organic molecular systems, the so-called molecular magnets. Metals 240-245 spindlin 1 Homo sapiens 142-146 27581060-1 2016 As an in-plane charge current flows in a heavy metal film with spin-orbit coupling, it produces a torque on and thereby switches the magnetization in a neighbouring ferromagnetic metal film. Metals 47-52 spindlin 1 Homo sapiens 63-67 27588878-1 2016 We theoretically investigate the dynamics of antiferromagnetic domain walls driven by spin-orbit torques in antiferromagnet-heavy-metal bilayers. Metals 130-135 spindlin 1 Homo sapiens 86-90 27477688-0 2016 Spin-polarized transport in hydrogen-passivated graphene and silicene nanoribbons with magnetic transition-metal substituents. Metals 107-112 spindlin 1 Homo sapiens 0-4 27578395-1 2016 Spin filtering at organic-metal interfaces is often determined by the details of the interaction between the organic molecules and the inorganic magnets used as electrodes. Metals 26-31 spindlin 1 Homo sapiens 0-4 27610880-1 2016 In ferromagnet-normal-metal heterostructures, spin pumping and spin-transfer torques are two reciprocal processes that occur concomitantly. Metals 22-27 spindlin 1 Homo sapiens 46-50 27610880-1 2016 In ferromagnet-normal-metal heterostructures, spin pumping and spin-transfer torques are two reciprocal processes that occur concomitantly. Metals 22-27 spindlin 1 Homo sapiens 63-67 27461135-2 2016 In such an intriguing phenomenon, the lattice may be coupled with dramatic changes of orbital and/or the spin-state of the transition metal. Metals 134-139 spindlin 1 Homo sapiens 105-109 27472125-1 2016 Planar spin transport in disordered ultrathin magnetic bilayers comprising a ferromagnet and a normal metal (typically used for spin pumping, spin Seebeck and spin-orbit torque experiments) is investigated theoretically. Metals 102-107 spindlin 1 Homo sapiens 7-11 27354325-0 2016 Near-Infrared-to-Visible Photon Upconversion Sensitized by a Metal Complex with Spin-Forbidden yet Strong S0-T1 Absorption. Metals 61-66 spindlin 1 Homo sapiens 80-84 26999481-1 2016 Spin-orbit torque, a torque brought about by in-plane current via the spin-orbit interactions in heavy-metal/ferromagnet nanostructures, provides a new pathway to switch the magnetization direction. Metals 103-108 spindlin 1 Homo sapiens 0-4 26999481-1 2016 Spin-orbit torque, a torque brought about by in-plane current via the spin-orbit interactions in heavy-metal/ferromagnet nanostructures, provides a new pathway to switch the magnetization direction. Metals 103-108 spindlin 1 Homo sapiens 70-74 27306000-4 2016 The observed relaxation enhancement is explained by laboratory-frame heteronuclear polarization exchange due to crossing between energy levels of spin-1/2 metal nuclei and adjacent quadrupolar-spin halogen nuclei. Metals 155-160 spindlin 1 Homo sapiens 146-154 27143686-3 2016 However, fundamental scientific understanding is lacking for the spin-exchange interaction between metal and metalloid atoms, which typically constitute a metallic glass. Metals 99-104 spindlin 1 Homo sapiens 65-69 27163862-3 2016 The analysis of the sigma and pi interaction between the metal and imide ligand shows that this spin crossover is caused by a subtle interplay of geometrical factors (Mn-N distance and coordination angle) and the electron-withdrawing character of the substituent on the imide, which reduces the electron donation to the metal center. Metals 57-62 spindlin 1 Homo sapiens 96-100 27163862-3 2016 The analysis of the sigma and pi interaction between the metal and imide ligand shows that this spin crossover is caused by a subtle interplay of geometrical factors (Mn-N distance and coordination angle) and the electron-withdrawing character of the substituent on the imide, which reduces the electron donation to the metal center. Metals 320-325 spindlin 1 Homo sapiens 96-100 27257254-1 2016 Exotic quantum states and fractionalized magnetic excitations, such as spinons in one-dimensional chains, are generally expected to occur in 3d transition metal systems with spin 1/2. Metals 155-160 spindlin 1 Homo sapiens 174-182 27189207-0 2016 Spin-crossover complex encapsulation within a magnetic metal-organic framework. Metals 55-60 spindlin 1 Homo sapiens 0-4 27125359-2 2016 Theoretical calculations showed this is the most stable geometry for d(0), d(10) and high spin d(5) metal complexes of the ligand with M-N bond distances >~2.35 A. Metals 100-105 spindlin 1 Homo sapiens 90-94 27149014-2 2016 In this study, molecular dynamics simulations using ligand-field molecular mechanics are performed to elucidate, for the first time, the molecular mechanisms responsible for the variation of the spin-crossover properties of the {Fe(pz)[Pt(CN)4]} metal-organic framework upon water adsorption. Metals 246-251 spindlin 1 Homo sapiens 195-199 27094967-2 2016 For an accurate reproduction of the electronic structure of transition metal systems, the spin orbit interaction is considered by using fully relativistic pseudopotentials (FRUP). Metals 71-76 spindlin 1 Homo sapiens 90-94 26990105-12 2016 On the contrary, it is highlighted that medium effects may contribute very significantly to spin-state energetics of transition metal complexes. Metals 128-133 spindlin 1 Homo sapiens 92-96 27042863-1 2016 Low-coordinate transition-metal complexes that undergo spin crossover remain rare. Metals 26-31 spindlin 1 Homo sapiens 55-59 26929084-1 2016 The influence of ligands on the spin state of a metal ion is of central importance for bioinorganic chemistry, and the production of base-metal catalysts for synthesis applications. Metals 48-53 spindlin 1 Homo sapiens 32-36 26923280-0 2016 Spin-polarized Dirac cones and topological nontriviality in a metal-organic framework Ni2C24S6H12. Metals 62-67 spindlin 1 Homo sapiens 0-4 26923280-3 2016 Here, using first-principles calculations, we propose a two-dimensional (2D) metal-organic framework (MOF), Ni2C24S6H12, with spin-polarized Dirac cones at the six corners of the Brillouin zone (BZ). Metals 77-82 spindlin 1 Homo sapiens 126-130 26895399-4 2016 A scaling is found for the critical Zeeman field in terms of the intrinsic coherence scale just below the metal-insulator transition, where the critical spin fluctuations are soft. Metals 106-111 spindlin 1 Homo sapiens 153-157 26926769-6 2016 These findings are ascribed with the aid of first-principles calculations to variations in the metal-molecule orientation that can be adjusted to obtain highly spin-selective orbital hybridization. Metals 95-100 spindlin 1 Homo sapiens 160-164 26926769-7 2016 Our results demonstrate the important role of geometrical considerations in determining the spin transport properties of metal-molecule interfaces. Metals 121-126 spindlin 1 Homo sapiens 92-96 26808695-0 2016 Evaluation of the Performance of the B3LYP, PBE0, and M06 DFT Functionals, and DBLOC-Corrected Versions, in the Calculation of Redox Potentials and Spin Splittings for Transition Metal Containing Systems. Metals 179-184 spindlin 1 Homo sapiens 148-152 26808695-1 2016 We have evaluated the performance of the M06 and PBE0 functionals in their ability to calculate spin splittings and redox potentials for octahedral complexes containing a first transition metal series atom. Metals 188-193 spindlin 1 Homo sapiens 96-100 26824687-2 2016 In this paper, we report a computational study for the calculation of the transition temperature (T(1/2)), a key physical quantity in the characterization of spin-crossover systems, for the family of tetracoordinated Fe(II) transition-metal complexes of generic formula [PhB(MesIm)3FeNPR1R2R3]. Metals 235-240 spindlin 1 Homo sapiens 158-162 26732649-2 2016 Herein, we show that visible-light-activated transition-metal complexes can be triplet sensitizers that selectively produce aziridines through the spin-selective photogeneration of triplet nitrenes from azidoformates. Metals 56-61 spindlin 1 Homo sapiens 147-151 26929084-1 2016 The influence of ligands on the spin state of a metal ion is of central importance for bioinorganic chemistry, and the production of base-metal catalysts for synthesis applications. Metals 138-143 spindlin 1 Homo sapiens 32-36 26564495-0 2015 Steering Metallofullerene Electron Spin in Porous Metal-Organic Framework. Metals 9-14 spindlin 1 Homo sapiens 35-39 26700960-1 2016 In transition-metal complexes, the geometric structure is intimately connected with the spin state arising from magnetic coupling between the paramagnetic ions. Metals 14-19 spindlin 1 Homo sapiens 88-92 26701372-2 2016 Depending on the electronic effects of the substituents on the ligand, the redox of the metal center was systematically modulated, and the magnetic behavior from essentially high-spin Co(II) in 3 versus completely diamagnetic Co(III) in 1 to Co(II) spin-crossover in 2 can be achieved. Metals 88-93 spindlin 1 Homo sapiens 179-183 26636191-0 2015 Four-Component Relativistic Density Functional Theory Calculations of EPR g- and Hyperfine-Coupling Tensors Using Hybrid Functionals: Validation on Transition-Metal Complexes with Large Tensor Anisotropies and Higher-Order Spin-Orbit Effects. Metals 159-164 spindlin 1 Homo sapiens 223-227 26575946-0 2015 Spin-Dependent Hybridization between Molecule and Metal at Room Temperature through Interlayer Exchange Coupling. Metals 50-55 spindlin 1 Homo sapiens 0-4 26575946-3 2015 Ab initio calculations predict a highly spin-polarized density of states at the Fermi level of this metal-molecule interface, thereby strengthening prospective spintronics applications. Metals 100-105 spindlin 1 Homo sapiens 40-44 26657930-1 2015 Binary transition metal dichalcogenide monolayers share common properties such as a direct optical bandgap, spin-orbit splittings of hundreds of meV, light-matter interaction dominated by robust excitons and coupled spin-valley states. Metals 18-23 spindlin 1 Homo sapiens 108-112 26657930-1 2015 Binary transition metal dichalcogenide monolayers share common properties such as a direct optical bandgap, spin-orbit splittings of hundreds of meV, light-matter interaction dominated by robust excitons and coupled spin-valley states. Metals 18-23 spindlin 1 Homo sapiens 216-220 26490692-0 2015 Interaction of Spin-Labeled Lipid Membranes with Transition Metal Ions. Metals 60-65 spindlin 1 Homo sapiens 15-19 26480333-1 2015 Spin-crossover metal complexes are highly promising magnetic molecular switches for prospective molecule-based devices. Metals 15-20 spindlin 1 Homo sapiens 0-4 26451571-0 2015 Spin Signature of Nonlocal Correlation Binding in Metal-Organic Frameworks. Metals 50-55 spindlin 1 Homo sapiens 0-4 26234424-2 2015 Here we assess the potential to impart a well-defined spin to individual catalytic Janus swimmers by using glancing angle metal evaporation onto a colloidal crystal to break the symmetry of the catalytic patch due to shadowing by neighbouring colloids. Metals 122-127 spindlin 1 Homo sapiens 54-58 26178258-0 2015 Nanoporosity, Inclusion Chemistry, and Spin Crossover in Orthogonally Interlocked Two-Dimensional Metal-Organic Frameworks. Metals 98-103 spindlin 1 Homo sapiens 39-43 26267848-2 2015 This change in coordination at the metal can also cause spin-state changes. Metals 35-40 spindlin 1 Homo sapiens 56-60 25820781-4 2015 Hemin, prototypical for the heme group in hemoglobin, is used to demonstrate the method, as a representative biomolecule where the spin state of a metal ion affects biological functions. Metals 147-152 spindlin 1 Homo sapiens 131-135 26030801-0 2015 Charge and Spin States in Schiff Base Metal Complexes with a Disiloxane Unit Exhibiting a Strong Noninnocent Ligand Character: Synthesis, Structure, Spectroelectrochemistry, and Theoretical Calculations. Metals 38-43 spindlin 1 Homo sapiens 11-15 26207505-0 2015 Spin Blocking in the Correlated Double-Electron Capture from Metal Surfaces. Metals 61-66 spindlin 1 Homo sapiens 0-4 26207505-3 2015 The double capture of electrons from the Fermi energy of the metal is dominated by the spin dependent electron correlation that blocks the occupation of triplet states in the ion, but creates a singlet two-hole final state at the surface, related to the concept of the exchange-correlation hole. Metals 61-66 spindlin 1 Homo sapiens 87-91 26574362-0 2015 Understanding the Electronic Factors Responsible for Ligand Spin-Orbit NMR Shielding in Transition-Metal Complexes. Metals 99-104 spindlin 1 Homo sapiens 60-64 26574362-3 2015 This leads to the chemical activation of metal 6s and 6p atomic orbitals in Au complexes and their larger participation in bonding with the ligand, which modulates the propagation of metal-induced SO effects on the NMR signal of the LA via the Spin-Orbit/Fermi Contact (SO/FC) mechanism. Metals 41-46 spindlin 1 Homo sapiens 244-248 26574362-3 2015 This leads to the chemical activation of metal 6s and 6p atomic orbitals in Au complexes and their larger participation in bonding with the ligand, which modulates the propagation of metal-induced SO effects on the NMR signal of the LA via the Spin-Orbit/Fermi Contact (SO/FC) mechanism. Metals 183-188 spindlin 1 Homo sapiens 244-248 25273418-0 2014 Most spin-1/2 transition-metal ions do have single ion anisotropy. Metals 25-30 spindlin 1 Homo sapiens 5-13 25610949-2 2015 The two iron centers are nonequivalent with admixed intermediate spin state (S = 3/2 with a minor contribution of S = 5/2) on each metal both in the solid and in solution. Metals 131-136 spindlin 1 Homo sapiens 65-69 25723231-5 2015 We present an intuitive picture of the spin reflection, analogous to that of Andreev reflection at metal-superconductor interfaces. Metals 99-104 spindlin 1 Homo sapiens 39-43 25494338-2 2015 It has been shown that by the proper choice of a linker group bridging the quinone rings and substituents in the diketonate fragments, complexes with the properties required in 2-qubit quantum gates (sufficiently narrow energy gaps between the spin states and weakly coupled paramagnetic centers) can be designed, in order to realize the mechanism of thermally driven migration of paramagnetic centers between the o-quinone fragments and metal atoms. Metals 438-443 spindlin 1 Homo sapiens 244-248 25169024-3 2014 The dc magnetic studies show that ferromagnetic metal-radical interactions take place in these hetero-tri-spin chain complexes, these and the next-neighbor interactions have been quantified for the Gd derivatives. Metals 48-53 spindlin 1 Homo sapiens 106-110 25273418-1 2014 The cause for the preferred spin orientation in magnetic systems containing spin-1/2 transition-metal ions was explored by studying the origin of the easy-plane anisotropy of the spin-1/2 Cu(2+) ions in CuCl2 2H2O, LiCuVO4, CuCl2, and CuBr2 on the basis of density functional theory and magnetic dipole-dipole energy calculations as well as a perturbation theory treatment of the spin-orbit coupling. Metals 96-101 spindlin 1 Homo sapiens 76-82 25273418-1 2014 The cause for the preferred spin orientation in magnetic systems containing spin-1/2 transition-metal ions was explored by studying the origin of the easy-plane anisotropy of the spin-1/2 Cu(2+) ions in CuCl2 2H2O, LiCuVO4, CuCl2, and CuBr2 on the basis of density functional theory and magnetic dipole-dipole energy calculations as well as a perturbation theory treatment of the spin-orbit coupling. Metals 96-101 spindlin 1 Homo sapiens 76-84 24976064-1 2014 Spin-torque nano-oscillators (STNOs) have outstanding advantages of a high degree of compactness, high-frequency tunability, and good compatibility with the standard complementary metal-oxide-semiconductor process, which offer prospects for future wireless communication. Metals 180-185 spindlin 1 Homo sapiens 0-4 25007978-3 2014 Here we show thermally driven ultrafast demagnetization of a perpendicular ferromagnet leads to spin accumulation in a normal metal and spin transfer torque in an in-plane ferromagnet. Metals 126-131 spindlin 1 Homo sapiens 96-100 24980875-1 2014 Transition metal ions with long-lived spin states represent minimum size magnetic bits. Metals 11-16 spindlin 1 Homo sapiens 38-42 25126936-3 2014 By calculating how electrons scatter off a normal metal-antiferromagnetic interface, we derive pumped spin and staggered spin currents in terms of the staggered field, the magnetization, and their rates of change. Metals 50-55 spindlin 1 Homo sapiens 102-106 25126936-3 2014 By calculating how electrons scatter off a normal metal-antiferromagnetic interface, we derive pumped spin and staggered spin currents in terms of the staggered field, the magnetization, and their rates of change. Metals 50-55 spindlin 1 Homo sapiens 121-125 24762041-0 2014 Spin-crossover and massive anisotropy switching of 5d transition metal atoms on graphene nanoflakes. Metals 65-70 spindlin 1 Homo sapiens 0-4 24753635-3 2014 The results show that the ISHE voltage depend on the damping constant of magnetic moment, suggesting that the precession energy tansferred to lattice/electron of normal metal is a key parameter to control the magnitude of spin current. Metals 169-174 spindlin 1 Homo sapiens 222-226 26583870-0 2013 Spin-Polarized Electron Transport Across Metal-Organic Molecules: A Density Functional Theory Approach. Metals 41-46 spindlin 1 Homo sapiens 0-4 24780927-7 2014 Our results demonstrate that ferromagnet-normal metal junctions are efficient sources of pure spin currents in the gigahertz frequency range. Metals 48-53 spindlin 1 Homo sapiens 94-98 24401766-1 2014 Spin-orbit interaction-driven phenomena such as the spin Hall and Rashba effect in ferromagnetic/heavy metal bilayers enables efficient manipulation of the magnetization via electric current. Metals 103-108 spindlin 1 Homo sapiens 0-4 24401766-1 2014 Spin-orbit interaction-driven phenomena such as the spin Hall and Rashba effect in ferromagnetic/heavy metal bilayers enables efficient manipulation of the magnetization via electric current. Metals 103-108 spindlin 1 Homo sapiens 52-56 23925373-0 2013 Photonic gratings of the metal-organic framework {Fe(bpac)[Pt(CN)4]} with synergetic spin transition and host-guest properties. Metals 25-30 spindlin 1 Homo sapiens 85-89 23925373-1 2013 Surface-relief photonic gratings of the spin-crossover metal-organic framework {Fe(bpac)[Pt(CN)4]} (bpac = bis(4-pyridyl)acetylene) were elaborated by the combination of a sequential assembly process and lithographic methods. Metals 55-60 spindlin 1 Homo sapiens 40-44 25166703-3 2013 The observation of unique domain patterns not reported for ferromagnetic metal microstructures, namely divergent antiferromagnetic vortex domains and "Z"-type domains, suggests the simultaneous presence of spin-flop coupling and local exchange bias in this system. Metals 73-78 spindlin 1 Homo sapiens 206-210 23892985-6 2013 Such torques include strongly anisotropic field-like and spin transfer-like components, which depend on the type of heavy metal layer and annealing treatment. Metals 122-127 spindlin 1 Homo sapiens 57-61 23745937-1 2013 The spin current pumped by a precessing ferromagnet into an adjacent normal metal has a constant polarization component parallel to the precession axis and a rotating one normal to the magnetization. Metals 76-81 spindlin 1 Homo sapiens 4-8 23938932-1 2013 The spin orbit interactions (SOI) of light mediated by single scattering from plasmon resonant metal nanoparticles (nanorods and nanospheres) are investigated using Jones and Mueller matrix polarimetry formalism. Metals 95-100 spindlin 1 Homo sapiens 4-8 24635343-0 2014 Spin tuning of electron-doped metal-phthalocyanine layers. Metals 30-35 spindlin 1 Homo sapiens 0-4 24635343-1 2014 The spin state of organic-based magnets at interfaces is to a great extent determined by the organic environment and the nature of the spin-carrying metal center, which is further subject to modifications by the adsorbate-substrate coupling. Metals 149-154 spindlin 1 Homo sapiens 4-8 24635343-1 2014 The spin state of organic-based magnets at interfaces is to a great extent determined by the organic environment and the nature of the spin-carrying metal center, which is further subject to modifications by the adsorbate-substrate coupling. Metals 149-154 spindlin 1 Homo sapiens 135-139 24549224-1 2014 Using the non-equilibrium Green"s function (NEGF) formalism within the sequential regime, we studied ultrahigh spin thermopower and pure spin current in single-molecule magnet(SMM), which is attached to nonmagnetic metal wires with spin bias and angle (theta) between the easy axis of SMM and the spin orientation in the electrodes. Metals 215-220 spindlin 1 Homo sapiens 111-115 24522173-5 2014 Comparison with time-resolved resistivity measurements suggests that the collapse of spin ordering is correlated with the insulator-to-metal transition, but the recovery of the insulating phase does not depend on the re-establishment of the spin ordering. Metals 135-140 spindlin 1 Homo sapiens 85-89 24252122-0 2013 Role of spin state and ligand charge in coordination patterns in complexes of 2,6-diacetylpyridinebis(semioxamazide) with 3d-block metal ions: a density functional theory study. Metals 131-136 spindlin 1 Homo sapiens 8-12 24252122-1 2013 We report here a systematic computational study on the effect of the spin state and ligand charge on coordination preferences for a number of 3d-block metal complexes with the 2,6-diacetylpyridinebis(semioxamazide) ligand and its mono- and dianionic analogues. Metals 151-156 spindlin 1 Homo sapiens 69-73 24252122-4 2013 Moreover, we find here that changes in the spin state lead to completely different coordination modes, in contrast to the usual situation that different spin states mainly result in changes in the metal-ligand bond lengths. Metals 197-202 spindlin 1 Homo sapiens 43-47 24252122-4 2013 Moreover, we find here that changes in the spin state lead to completely different coordination modes, in contrast to the usual situation that different spin states mainly result in changes in the metal-ligand bond lengths. Metals 197-202 spindlin 1 Homo sapiens 153-157 24126435-4 2013 Spin diffusion across the metal-metal (Cu to CoFe) interface between the pillar and the lead causes spin accumulation in the pillar, which may then be used to set the magnetic orientation of the pillar. Metals 26-31 spindlin 1 Homo sapiens 0-4 24126435-4 2013 Spin diffusion across the metal-metal (Cu to CoFe) interface between the pillar and the lead causes spin accumulation in the pillar, which may then be used to set the magnetic orientation of the pillar. Metals 26-31 spindlin 1 Homo sapiens 100-104 24126435-4 2013 Spin diffusion across the metal-metal (Cu to CoFe) interface between the pillar and the lead causes spin accumulation in the pillar, which may then be used to set the magnetic orientation of the pillar. Metals 32-37 spindlin 1 Homo sapiens 0-4 24126435-4 2013 Spin diffusion across the metal-metal (Cu to CoFe) interface between the pillar and the lead causes spin accumulation in the pillar, which may then be used to set the magnetic orientation of the pillar. Metals 32-37 spindlin 1 Homo sapiens 100-104 24160625-2 2013 Since the magnitude of the measured anisotropy is remarkably small, up to an order of magnitude smaller than previously reported, electron-hole excitations are weak and thus the spin excitation exhibits long lived precessional lifetimes compared to the values found for the same adatom on noble metal surfaces. Metals 295-300 spindlin 1 Homo sapiens 178-182 23420561-1 2013 The spin Seebeck effect refers to the generation of a spin voltage caused by a temperature gradient in a ferromagnet, which enables the thermal injection of spin currents from the ferromagnet into an attached nonmagnetic metal over a macroscopic scale of several millimeters. Metals 221-226 spindlin 1 Homo sapiens 4-8 23420561-1 2013 The spin Seebeck effect refers to the generation of a spin voltage caused by a temperature gradient in a ferromagnet, which enables the thermal injection of spin currents from the ferromagnet into an attached nonmagnetic metal over a macroscopic scale of several millimeters. Metals 221-226 spindlin 1 Homo sapiens 54-58 23420561-1 2013 The spin Seebeck effect refers to the generation of a spin voltage caused by a temperature gradient in a ferromagnet, which enables the thermal injection of spin currents from the ferromagnet into an attached nonmagnetic metal over a macroscopic scale of several millimeters. Metals 221-226 spindlin 1 Homo sapiens 54-58 26281742-3 2013 Although these three radical species have the same parent fullerene cage, we found that the unpaired spin characteristics as well as metal-spin couplings of them can be greatly affected by endohedral clusters. Metals 133-138 spindlin 1 Homo sapiens 139-143 26605585-0 2012 Accurate Spin-State Energetics of Transition Metal Complexes. Metals 45-50 spindlin 1 Homo sapiens 9-13 26290968-1 2012 Spin-state switching of transition-metal complexes (spin crossover) is sensitive to a variety of tiny perturbations. Metals 35-40 spindlin 1 Homo sapiens 0-4 26290968-1 2012 Spin-state switching of transition-metal complexes (spin crossover) is sensitive to a variety of tiny perturbations. Metals 35-40 spindlin 1 Homo sapiens 52-56 23140235-0 2012 Structural and magnetic properties of small 4d transition metal clusters: role of spin-orbit coupling. Metals 58-63 spindlin 1 Homo sapiens 82-86 23023645-3 2012 Here, we show that single-layer graphene successfully circumvents the classic issue of conductivity mismatch between a metal and a semiconductor for electrical spin injection and detection, providing a highly uniform, chemically inert and thermally robust tunnel barrier. Metals 119-124 spindlin 1 Homo sapiens 160-164 23378866-4 2012 We employ the tip of a low-temperature scanning tunneling microscope as a local probe in combination with density functional theory calculations to investigate with atomic precision the electronic and geometric effects of a weakly interacting metal support on an archetypal hydrocarbon radical model system, i.e., the exceptionally stable spin-1/2 radical alpha,gamma-bisdiphenylene-beta-phenylallyl (BDPA). Metals 243-248 spindlin 1 Homo sapiens 339-345 22462849-15 2012 Overall, these calculations demonstrate the potential of using spin-adaptation to extend the range of DMRG calculations in complex transition metal problems. Metals 142-147 spindlin 1 Homo sapiens 63-67 23005320-3 2012 The heavy-hole spin transformations are realized by transporting the hole around closed loops defined by metal gates deposited on top of the nanodevice. Metals 105-110 spindlin 1 Homo sapiens 15-19 26593657-1 2012 The transition metal-dependent spin-orbit coupling (SOC) and outer-core (5s5p) correlation effects in Ir- and Pt-catalyzed C-H activation processes are studied here using high level ab initio computations. Metals 15-20 spindlin 1 Homo sapiens 31-35 26593346-7 2012 The metal-ligand magnetic interaction is estimated using the second order perturbation energy for ligand to metal charge transfer and spin densities on the concerned sites. Metals 4-9 spindlin 1 Homo sapiens 134-138 22182114-1 2011 We consider dc-electronic transport through a nanowire suspended between normal- and spin-polarized metal leads in the presence of an external magnetic field. Metals 100-105 spindlin 1 Homo sapiens 85-89