A coupled cluster and Møller-Plesset perturbation theory study of the pressure induced phase transition in the LiH crystal

Journal of Chemical Physics

Volumn 143, Issue 10, 2015, Pages

  Grüneis, Andreas ^a,b  

^a MAX PLANCK INSTITUT FÜR FESTKÖRPERFORSCHUNG   (Germany)

^b UNIVERSITY OF VIENNA   (Austria)

Author keywords

[No Author keywords available]

Indexed keywords

CESIUM COMPOUNDS; CLUSTER ANALYSIS; CRYSTAL STRUCTURE; LITHIUM ALLOYS; MOLECULAR PHYSICS; NUMERICAL METHODS; POTENTIAL ENERGY; QUANTUM CHEMISTRY; WAVE FUNCTIONS;

COUPLED CLUSTERS; COUPLED-CLUSTER SINGLES AND DOUBLES; PARAMETER SPACES; PLESSET PERTURBATION THEORY; PRESSURE-INDUCED PHASE TRANSITION; PRESSURE-INDUCED TRANSITIONS; STRUCTURAL PHASE TRANSITION; TRANSITION PRESSURE;

PERTURBATION TECHNIQUES;

EID: 84941236677     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4928645     Document Type: Article

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