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Computer Modeling and Simulation of Geofluids: A General Review and Sample Description
引用本文:胡文XUAN 段振豪 等. Computer Modeling and Simulation of Geofluids: A General Review and Sample Description[J]. 中国地球化学学报, 1997, 16(3): 240-247. DOI: 10.1007/BF02870907
作者姓名:胡文XUAN 段振豪 等
作者单位:[1]DepartmentofEarthSciences,NanjingUniversity,Nanjing210093 [2]DepartmentofChemistry,0340,UniversityofCaliformia,SanDiegoLaJolla,CA92093-0340,U.S.A
摘    要:
Thermodynamic properties of fluids are essential for the understanding of the geochemical behavior of various processes,The paper introduces the most updated computer modeling and simulation methods in the study of thermodynamics of geofluids,inclduing semiempirical models(such as equation of state)and molecular dynamics and Monte Carlo simulation.A well-established semi-empirical model can interpolate and extrapolate experimental data and yield much physicochemical information.Computer modeling may produce“experimental data“ yield much physicochemical information.Computer modeling may produce“experimental data“even under experimentally difficult conditions.They provide important methods for the study of geological fluid systems on the quantitative basis.

关 键 词:计算机模拟 平衡态 热力学 地热能 地质流体 石油

Computer modeling and simulation of geofluids: A general review and sample description
Wenxuan Hu,Zhenhao Duan,Qijiang Ren. Computer modeling and simulation of geofluids: A general review and sample description[J]. Chinese Journal of Geochemistry, 1997, 16(3): 240-247. DOI: 10.1007/BF02870907
Authors:Wenxuan Hu  Zhenhao Duan  Qijiang Ren
Affiliation:1. Department of Earth Sciences, Nanjing University, 210093, Nanjing
2. Department of Chemistry, 0340, University of California, 92093-0340, San Diego La Jolla, CA, U. S. A.
Abstract:
Thermodynamic properties of fluids are essential for the understanding of the geochemical behavior of various processes. The paper introduces the most updated computer modeling and simulation methods in the study of thermodynamics of geofluids, including semiempirical models (such as equation of state) and molecular dynamics and Monte Carlo simulation. A well-established semi-empirical model can interpolate and extrapolate experimental data and yield much physicochemical information. Computer modeling may produce “experimental data” even under experimentally difficult conditions. They provide important methods for the study of geological fluid systems on the quantitative basis.
Keywords:
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