Title of article
The adaptive integration method for calculating general free energy functions Original Research Article
Author/Authors
Robert H. Swendsen، نويسنده , , Marc Fasnacht، نويسنده , , John M. Rosenberg and Linda Jen-Jacobson، نويسنده ,
Issue Information
دوهفته نامه با شماره پیاپی سال 2005
Pages
3
From page
274
To page
276
Abstract
We describe a new adaptive sampling method for computing free energies for a wide variety of applications. The method is both simple and accurate. Results for thermodynamic quantities are obtained with this method in the form of continuous functions.
Keywords
Free-energy calculations , Histogram methods , Radial distribution function , Monte Carlo , Adaptive sampling , Lennard–Jones fluid
Journal title
Computer Physics Communications
Serial Year
2005
Journal title
Computer Physics Communications
Record number
1136886
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