Boundary based on exchange symmetry theory for multilevel simulations. II. Multiple time scale approach

Journal of Chemical Physics

Volumn 139, Issue 14, 2013, Pages

  Shiga, Motoyuki ^a   Masia, Marco ^b,c  

^a JAPAN ATOMIC ENERGY AGENCY   (Japan)

^b UNIVERSITY OF SASSARI   (Italy)

^c GOETHE UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ANISOTROPIC ANGULAR DISTRIBUTION; MULTI-SCALE SIMULATION; MULTILEVEL SIMULATION; MULTIPLE TIME SCALE ALGORITHMS; PATH-INTEGRAL MOLECULAR DYNAMICS; QUANTUM DESCRIPTION; RADIAL DISTRIBUTION FUNCTIONS; SIMULATION TECHNIQUE;

MOLECULAR DYNAMICS;

HYDRATION;

ALGORITHM; ANISOTROPY; MOLECULAR DYNAMICS; QUANTUM THEORY; TIME; ARTICLE;

ALGORITHMS; ANISOTROPY; MOLECULAR DYNAMICS SIMULATION; QUANTUM THEORY; TIME FACTORS;

EID: 84886872584     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4823729     Document Type: Article

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