Constant-Pressure Monte Carlo Simulations for Lattice Models
نویسندگان
چکیده
منابع مشابه
Monte Carlo simulations of lattice models for single polymer systems.
Single linear polymer chains in dilute solutions under good solvent conditions are studied by Monte Carlo simulations with the pruned-enriched Rosenbluth method up to the chain length N~O(10(4)). Based on the standard simple cubic lattice model (SCLM) with fixed bond length and the bond fluctuation model (BFM) with bond lengths in a range between 2 and √10, we investigate the conformations of p...
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Adaptation and implementation of the Generalized Shadow Hybrid Monte Carlo (GSHMC) method for molecular simulation at constant pressure in the NPT ensemble are discussed. The resulting method, termed NPT-GSHMC, combines Andersen barostat with GSHMC to enable molecular simulations in the environment natural for biological applications, namely, at constant pressure and constant temperature. Gener...
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ژورنال
عنوان ژورنال: Europhysics Letters (EPL)
سال: 1994
ISSN: 0295-5075,1286-4854
DOI: 10.1209/0295-5075/27/7/010