Hydrogen bond symmetrization and superconducting phase of HBr and HCl under high pressure: An ab initio study

Journal of Chemical Physics

Volumn 133, Issue 7, 2010, Pages

  Duan, Defang ^a   Tian, Fubo ^a   He, Zhi ^a   Meng, Xing ^a   Wang, Liancheng ^a   Chen, Changbo ^a   Zhao, Xiusong ^a   Liu, Bingbing ^a   Cui, Tian ^a  

^a JILIN UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; AB INITIO STUDY; HIGH PRESSURE; HYDROGEN BONDINGS; LINEAR RESPONSE; METALLIC PHASE; MONOCLINIC STRUCTURES; PHONON CALCULATION; PRESSURE RANGES; SUPERCONDUCTING BEHAVIOR; SUPERCONDUCTING PHASE; TRANSVERSE ACOUSTIC PHONONS;

HYDROGEN; PHONONS; SUPERCONDUCTIVITY;

HYDROGEN BONDS;

HYDROBROMIC ACID; HYDROCHLORIC ACID;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; ELECTRIC CONDUCTIVITY; HYDROGEN BOND; PHASE TRANSITION; PRESSURE; QUANTUM THEORY;

ELECTRIC CONDUCTIVITY; HYDROBROMIC ACID; HYDROCHLORIC ACID; HYDROGEN BONDING; MODELS, MOLECULAR; MOLECULAR CONFORMATION; PHASE TRANSITION; PRESSURE; QUANTUM THEORY;

EID: 77956086722     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3471446     Document Type: Article

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