Concepedia

Vapor-liquid equilibria of CH4, CO2 and their binary system CH4 + CO2: A comparison between the molecular simulation and equation of state

Zhi Yang, Maoqiong Gong, Yuan Zhou, Xueqiang Dong, Xiaodong Li, Huiya Li, Jianfeng Wu

Science China Technological Sciences · 2015 · 13 citations · 51 references

DOI

Concepts

References

51

Computer Simulation of Liquids

S. P, K. J · Journal of Molecular Liquids · 1988 · 15.9K citations

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Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids

William L. Jorgensen, David S. Maxwell, Julian Tirado‐Rives · Journal of the American Chemical Society · 1996 · 15.3K citations

, , +17

All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins

Alexander D. MacKerell, Donald Bashford, M. Bellott et al. · The Journal of Physical Chemistry B · 1998 · 14.5K citations

, , +17

A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules

Wendy D. Cornell, Piotr Cieplak, Christopher I. Bayly et al. · Journal of the American Chemical Society · 1995 · 13.1K citations

, , +17

A New Two-Constant Equation of State

Ding‐Yu Peng, Donald B. Robinson · Industrial & Engineering Chemistry Fundamentals · 1976 · 12.8K citations

, , +4