Title : First-principles approach to calculating energy level alignment at aqueous semiconductor interfaces.

Pub. Date : 2014 Oct 24

PMID : 25379929






1 Functional Relationships(s)
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1 The application to the specific cases of nonpolar (101 0) facets of GaN and ZnO reveals a significant role for the structural motifs at the interface, including the degree of interface water dissociation and the dynamical fluctuations in the interface Zn-O and O-H bond orientations. Water gigaxonin Homo sapiens