Bulk ionization potentials and band alignments from three-dimensional periodic calculations as demonstrated on rocksalt oxides (2014)

First Author: Logsdail A
Attributed to:  Scalable Quantum Chemistry with Flexible Embedding Stage 2 funded by EPSRC

Abstract

No abstract provided

Bibliographic Information

Digital Object Identifier: http://dx.doi.org/10.1103/physrevb.90.155106

Publication URI: http://dx.doi.org/10.1103/physrevb.90.155106

Type: Journal Article/Review

Parent Publication: Physical Review B

Issue: 15