Revisiting photoemission and inverse photoemission spectra of nickel oxide from first principles: Implications for solar energy conversion

Journal of Physical Chemistry B

Volumn 118, Issue 28, 2014, Pages 7963-7971

  Alidoust, Nima ^a   Toroker, Maytal Caspary ^b   Carter, Emily A ^c  

^a Princeton University   (United States)

^b TECHNION ISRAEL INSTITUTE OF TECHNOLOGY   (Israel)

^c PRINCETON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CONDUCTION BANDS; ELECTRONIC STRUCTURE; ENERGY CONVERSION; MEAN FIELD THEORY; MOLECULAR ORBITALS; NICKEL; NICKEL OXIDE; OXYGEN; QUANTUM THEORY; SOLAR ENERGY;

BAND GAP ENGINEERING; COMPLETE ACTIVE SPACE SELF-CONSISTENT FIELDS; CONDUCTION BAND EDGE; ELECTRON TRANSPORT; ELECTRON-HOLE RECOMBINATION; INVERSE PHOTOEMISSION; TRANSITION-METAL OXIDES; VALENCE BAND EDGES;

PHOTOEMISSION;

EID: 84904578101     PISSN: 15206106     EISSN: 15205207     Source Type: Journal    
DOI: 10.1021/jp500878s     Document Type: Article

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