Variational path integral molecular dynamics and hybrid Monte Carlo algorithms using a fourth order propagator with applications to molecular systems

Journal of Chemical Physics

Volumn 145, Issue 7, 2016, Pages

  Kamibayashi, Yuki ^a   Miura, Shinichi ^a  

^a KANAZAWA UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

MATRIX ALGEBRA; MOLECULAR DYNAMICS; MOLECULES; QUANTUM THEORY;

ANALYTICAL EXPRESSIONS; FOURTH-ORDER APPROXIMATION; HYBRID MONTE CARLO ALGORITHM; HYBRID MONTE-CARLO METHODS; MANY-BODY INTERACTIONS; MOLECULAR DYNAMICS METHODS; PARA-HYDROGEN CLUSTERS; PATH-INTEGRAL MOLECULAR DYNAMICS;

MONTE CARLO METHODS;

EID: 84983500254     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4961149     Document Type: Article

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