PMID-sentid Pub_year Sent_text comp_official_name comp_offsetprotein_name organism prot_offset 27193867-0 2016 Oxygen diffusion in ThO2-CeO2 and ThO2-UO2 solid solutions from atomistic calculations. Oxygen 0-6 THO complex 2 Homo sapiens 20-24 27193867-0 2016 Oxygen diffusion in ThO2-CeO2 and ThO2-UO2 solid solutions from atomistic calculations. Oxygen 0-6 THO complex 2 Homo sapiens 34-38 27193867-1 2016 We elucidate oxygen diffusivity in ThO2-CeO2 and ThO2-UO2 solid solutions across their whole concentration ranges in the phase diagram using static pair-potential calculations and molecular dynamics simulations. Oxygen 13-19 THO complex 2 Homo sapiens 35-39 27193867-1 2016 We elucidate oxygen diffusivity in ThO2-CeO2 and ThO2-UO2 solid solutions across their whole concentration ranges in the phase diagram using static pair-potential calculations and molecular dynamics simulations. Oxygen 13-19 THO complex 2 Homo sapiens 49-53 27193867-2 2016 Between pure CeO2 (and UO2) and pure ThO2, oxygen diffusivity is higher in CeO2 (and UO2) due to lower oxygen migration barriers. Oxygen 43-49 THO complex 2 Homo sapiens 37-41 27193867-2 2016 Between pure CeO2 (and UO2) and pure ThO2, oxygen diffusivity is higher in CeO2 (and UO2) due to lower oxygen migration barriers. Oxygen 103-109 THO complex 2 Homo sapiens 37-41 27193867-4 2016 On the other side of the phase diagram, with the addition of Ce to ThO2 oxygen diffusion decreases due to oxygen vacancy binding with Ce, even though the migration barriers decrease due to the smaller size of Ce than the host Th. Oxygen 72-78 THO complex 2 Homo sapiens 67-71