Recovering the Crooks equation for dynamical systems in the isothermal-isobaric ensemble: A strategy based on the equations of motion

Journal of Chemical Physics

Volumn 126, Issue 4, 2007, Pages

  Chelli, Riccardo ^a   Marsili, Simone ^b   Barducci, Alessandro ^b   Procacci, Piero ^b  

^a UNIVERSITY OF FLORENCE   (Italy)

^b UNIVERSITY OF FLORENCE   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTER SIMULATION; EQUATIONS OF MOTION; FREE ENERGY; MOLECULAR DYNAMICS; PHASE TRANSITIONS; THEOREM PROVING; THERMOSTATS;

CROOKS EQUATION; HOOVER CHAIN METHOD; ISOTHERMAL-ISOBARIC ENSEMBLE; JARZYNSKI IDENTITY;

DIFFERENTIAL EQUATIONS;

EID: 33847722656     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2424940     Document Type: Article

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