Improving the structural description of high-temperature liquid GeSe 2 from ab initio molecular dynamics simulations

Journal of Optoelectronics and Advanced Materials

Volumn 11, Issue 12, 2009, Pages 1907-1914

  Micoulaut, M ^a   Massobrio, C ^b  

^a UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

^b INSTITUT DE PHYSIQUE ET CHIMIE DES MATÉRIAUX DE STRASBOURG   (France)

Author keywords

Ab initio molecular dynamics; Liquid GeSe2

Indexed keywords

GERMANIUM COMPOUNDS; LIQUIDS; NEUTRON DIFFRACTION; SELENIUM COMPOUNDS;

AB INITIO MOLECULAR DYNAMICS; AB INITIO MOLECULAR DYNAMICS SIMULATION; DENSITY FUNCTIONALS; DYNAMICAL PROPERTIES; FIRST PRINCIPLES MOLECULAR DYNAMICS; HIGH-TEMPERATURE LIQUIDS; SELF-DIFFUSION CONSTANT; STRUCTURAL DESCRIPTIONS;

MOLECULAR DYNAMICS;

EID: 75949085275     PISSN: 14544164     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

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