Thermodynamic integration from classical to quantum mechanics

Journal of Chemical Physics

Volumn 135, Issue 22, 2011, Pages

  Habershon, Scott ^a   Manolopoulos, David E ^b  

^a UNIVERSITY OF BRISTOL   (United Kingdom)

^b UNIVERSITY OF OXFORD   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

FLEXIBLE WATER MODELS; HARMONIC OSCILLATORS; QUANTUM DELOCALIZATIONS; QUANTUM MECHANICAL; QUANTUM MECHANICAL CORRECTION; THERMODYNAMIC INTEGRATION;

FREE ENERGY;

QUANTUM THEORY;

EID: 83755225738     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3666011     Document Type: Article

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