Molecular dynamics simulation study on behaviors of liquid 1,2-dichloroethane under external electric fields
Author:
Publisher
Zhejiang University Press
Subject
General Engineering
Link
https://link.springer.com/content/pdf/10.1631/BF02841082.pdf
Reference9 articles.
1. Anderson, H. C., 1983. Rattle: a “velocity” version of the shake algorithm for molecular dynamics calculations.J. Comp. Phys.,52: 24–34.
2. Bohm, H. J., Lynden-Bell, R. M., Madden, P. A. and McDonald, I. R., 1984. Molecular motion in a model of liquid acetonitrile.Molecular Physics,51(3): 761–777.
3. Clark, M., Cramer, III, R. D. and Van Opdenbosch, N., 1989. Validation of the general purpose Tripos 5. 2 force field.J. Comp. Chem.,10(8): 982–1012.
4. Green, M. E. and Lu, J., 1997, Simulation of water in a small pore: effect of electric and density.J. Phys. Chem. B,101:6512–6524.
5. Jorgensen, W. L., Binning, R. C. Jr. and Bigot, B., 1981, Structures and property of organic liquids: n-Butane and 1,2-dichloroethane and their conformational equilibrium.J. Am. Chem. Soc.,103(15): 4393–4399.
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