Extrapolation and perturbation schemes for accelerating the convergence of quantum mechanical free energy calculations via the Fourier path-integral Monte Carlo method

Journal of Chemical Physics

Volumn 112, Issue 20, 2000, Pages 8758-8764

  Mielke, Steven L ^a,c   Srinivasan, Jay ^b   Truhlar, Donald G ^b  

^a PACIFIC NORTHWEST NATIONAL LABORATORY   (United States)

^b University of Minnesota   (United States)

^c JOHNS HOPKINS UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001440371     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.481491     Document Type: Article

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