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Angewandte Chemie - International Edition

Volumn 54, Issue 42, 2015, Pages 12437-12441

Theory of Hydrogen Migration in Organic-Inorganic Halide Perovskites

(3) Egger, David A a Kronik, Leeor a Rappe, Andrew M b

a WEIZMANN INSTITUTE OF SCIENCE (Israel)

b UNIVERSITY OF PENNSYLVANIA (United States)

Author keywords

density functional calculations; hybrid perovskites; proton transport; solar cells

Indexed keywords

CALCULATIONS; CHEMICAL BONDS; DEFECT DENSITY; DEFECTS; DENSITY FUNCTIONAL THEORY; HYDROGEN; HYDROGEN BONDS; HYSTERESIS; PEROVSKITE; SOLAR CELLS; SOLAR POWER GENERATION;

BOURGOIN-CORBETT MECHANISMS; CURRENT VOLTAGE CURVE; FIRST-PRINCIPLES CALCULATION; HYDROGEN MIGRATION; INTERSTITIAL HYDROGEN; MIGRATION BARRIERS; PROTON TRANSPORT; STRUCTURAL FLEXIBILITIES;

CRYSTAL DEFECTS;

EID: 84942808169 PISSN: 14337851 EISSN: 15213773 Source Type: Journal
DOI: 10.1002/anie.201502544 Document Type: Article

Times cited : (144)

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