Molecular simulation for R1123 thermophysical properties
Author:
Affiliation:
1. Dept. of Mechanical Engineering, Nagasaki University
Publisher
The Japan Society of Thermophysical Properties
Subject
General Medicine
Link
https://www.jstage.jst.go.jp/article/jjtp/36/3/36_96/_pdf
Reference20 articles.
1. [1] G. Raabe, E.J.Maginn; “Molecular modeling of the vapor-liquid equilibrium properties of the alternative refrigerant 2,3,3,3-tetrafluoro-1-propene (HFO-1234yf)”. J. Phys. Chem. Lett., 1 (2010) 93–96.
2. [2] M.S.Alam, J.H.Jeong; “Thermodynamic properties and critical parameters of HFO-1123 and its binary blends with HFC-32 and HFC-134a using molecular simulations” Int. J. Refrig., 104 (2019) 311-320.
3. [3] H. Sun, “COMPASS: an ab initio force-field optimized for condensed-phase applications overview with details on alkane and benzene compounds” J. Phys. Chem. B, 102, 38 (1998) 7338-7364.
4. [4] G.A.Kaminski, R.A.Friesner, J.Tirado-Rives, W.L.E. Jorgensen; “Evaluation and Reparameterization of the OPLS-AA Force Field for Proteins via Comparison with Accurate Quantum Chemical Calculations on Peptides” J. Phys. Chem. B, 105 (2001) 6474−6487.
5. [5] Gaussian16, Gaussian, Inc., Wallingford CT, 2016.
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