Conformational analysis of liquid dimethyl carbonate by molecular dynamics calculations

Molecular Physics

Volumn 93, Issue 1, 1998, Pages 153-158

  Okada, Okimasa ^a  

^a FUJI XEROX CO LTD   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000592853     PISSN: 00268976     EISSN: None     Source Type: Journal    
DOI: 10.1080/002689798169546     Document Type: Article

References (23)

1. LABRENZ, D., and SCHRÖER, W., 1991, J. molec. Struct., 249, 327.
2. MIZUSHIMA, S. I., and KUBO, M., 1939, Bull. chem. Soc. Jap., 60, 1208.
3. THIEVAUT, J. M., RIVAIL, J. L., and GREFFE, J. L., 1976, J chem Soc. Faraday Trans ii, 72, 2024.
4. CHIA, L. H., and KWAN, K. J., 1981, Aust. J. Chem., 34, 349.
5. THOMAS, G., 1939, J. chem. Soc., 1228.
6. KATON, J. E., and COHEN, M. D., 1974, Can. J. Chem., 52, 1994.
7. KATON, J. E., and COHEN, M. D., 1975, Can. J. Chem., 53, 1378.
8. COLLINGWOOD, B., LEE, H., and WILENSHURST, J., 1966, Aust. J. Chem., 19, 1637.
9. EVANS, M. W., AFSAR, M. N., DAVIES, G. J., MENARD, C., and GOULON, J., 1977, Chem. Phys. Lett., 52, 388.
10. WALKER, E. E., 1952, J. appl. Chem., 2, 470.
11. OKI, M., and NAKANISHI, H., 1971, Bull. chem. Soc. Jap., 44, 3419.
12. MIJHOFF, F. C., 1977, J. molec. Struct., 36, 334.
13. ALLEN, M. P., and TILDESLEY, D. J., 1987, The Computer Simulation of Liquids (Oxford: Clarendon Press).
14. KUWAJIMA, S., OSAKA, T., and NOMA, H., 1995, Proceedings of the 5th Symposium of Computational Chemistry in Japan, p. 108.
15. JORGENSEN, W. L., MADURA, J. D., and SWENSON, C. J., 1984, J. Amer. chem. Soc., 106, 6638.
16. NOSÉ, S., and KLEIN, K. L., 1983, Molec. Phys., 50, 1055.
17. NOSE, S., 1991, Progr. theoret. Phys. Suppl., 103, 1.
18. HOOVER, W. G., 1985, Phys. Rev. A, 31, 1695.
19. PARRINELLO, M., and RAHMAN, A., 1980, Phys. Rev. Lett., 45, 1196.
20. PARRINELLO, M., and RAHMAN, A., 1981, J. appl. Phys., 52, 7183.
21. ANDERSON, H. C., 1980, J. chem. Phys., 72, 2384.
22. EWALD, P., 1921, Ann. Phys., 64, 253.
23. LINSE, P., and ANDERSEN, H. C., 1986, J. chem. Phys., 85, 3027.