Determination of the free energy of water at room temperature by parallel grand canonical Monte Carlo

被引：0
|
作者：
Hernandez-Cobos, J. [1 ]
Vega, L.F. [1 ]
Mackie, Allan D. [1 ]
机构：
[1] Universidad Nacional Autonoma de, Mexico, Morelos, Mexico
来源：
Computer Physics Communications | 1999年 / 121卷
关键词：
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
相关论文
共 50 条
  • [31] Replica-Exchange and Standard State Binding Free Energies with Grand Canonical Monte Carlo
    Ross, Gregory A.
    Macdonald, Hannah E. Bruce
    Cave-Ayland, Christopher
    Martinez, Ana I. Cabedo
    Essex, Jonathan W.
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2017, 13 (12) : 6373 - 6381
  • [32] Spatially adaptive grand canonical ensemble Monte Carlo simulations
    Chatterjee, A
    Katsoulakis, MA
    Vlachos, DG
    PHYSICAL REVIEW E, 2005, 71 (02):
  • [33] Grand canonical Monte Carlo simulations of equilibrium polymers and networks
    Kindt, JT
    MESOSCALE PHENOMENA IN FLUID SYSTEMS, 2003, 861 : 298 - 312
  • [34] Utilizing Grand Canonical Monte Carlo Methods in Drug Discovery
    Bodnarchuk, Michael S.
    Packer, Martin J.
    Haywood, Alexe
    ACS MEDICINAL CHEMISTRY LETTERS, 2020, 11 (01): : 77 - 82
  • [35] Fourier path integral Monte Carlo in the grand canonical ensemble
    López, GE
    CHEMICAL PHYSICS LETTERS, 2003, 375 (5-6) : 511 - 516
  • [36] Sequential updating algorithms for grand canonical Monte Carlo simulations
    Ren, Ruichao
    O'Keeffe, C. J.
    Orkoulas, G.
    MOLECULAR PHYSICS, 2007, 105 (2-3) : 231 - 238
  • [37] GRAND CANONICAL MONTE-CARLO SIMULATION OF LIQUID ARGON
    RUFF, I
    BARANVAI, A
    PALINKAS, G
    HEINZINGER, K
    JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (04): : 2169 - 2177
  • [38] Grand-canonical Monte Carlo method for Donnan equilibria
    Barr, S. A.
    Panagiotopoulos, A. Z.
    PHYSICAL REVIEW E, 2012, 86 (01):
  • [39] Grand canonical Monte Carlo simulations of elastic membranes with fluidity
    Koibuchi, H
    Kusano, N
    Nidaira, A
    Suzuki, K
    Yamada, M
    PHYSICS LETTERS A, 2003, 319 (1-2) : 44 - 52
  • [40] Grand Canonical Monte Carlo Study of Li Intercalation into Graphite
    Gavilan-Arriazu, E. M.
    Pinto, O. A.
    Lopez de Mishima, B. A.
    Leiva, E. P. M.
    Oviedo, O. A.
    JOURNAL OF THE ELECTROCHEMICAL SOCIETY, 2018, 165 (10) : A2019 - A2025
12345