A quantum chemistry study of Qinghaosu

Chemical Physics Letters

Volumn 277, Issue 1-3, 1997, Pages 234-238

  Gu, Jian De ^a,b   Chen, Kai Xian ^a   Jiang, Hua Liang ^a   Zhu, Wei Liang ^a   Chen, Jian Zhong ^a   Ji, Ru Yun ^a  

^a SHANGHAI INSTITUTE OF MATERIA MEDICA   (China)

^b UNIVERSITY OF GEORGIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0031551518     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(97)00877-4     Document Type: Article

References (12)

1. [1] D.L. Klayman, Science 228 (1985) 1049.
2. [2] Qinghaosu Research Group, Sci. Sinica 23 (1980) 380.
3. [3] C. Thomson, M. Cory, M. Zerner, Int. J. Quant. Chem. Biol. Sym. 18 (1991) 231.
4. [4] Y. Tang, H.L. Jiang, K.X. Chen, R.Y. Ji, Ind. J. Chem. 35B (1996) 325.
5. [5] H.L. Jiang, K.X. Chen, Y. Tang, J.Z. Chen, R.Y. Ji, Chin. J. Chem. 13 (1995) 131.
6. [6] Y. Fang, Z. Zhu, D. He, Huaxue Xuebao 42 (1984) 1312.
7. [7] M. Mohnhaupt, H. Hagemann, J.-P. Perler, H. Bill, J. Boukouvalas, J.-C. Rossier, C.W. Jefford, Helv. Chim. Acta 71 (1988) 992.
8. [8] X. Xu, D. Huang, J. Zhu, W. Zhou, Huaxue Xuebao 40 (1982) 1081.
9. [9] A.D. Becke, J. Chem. Phys. 98 (1993) 5648.
10. [10] C. Lee, W. Yang, R.G. Parr, Phys. Rev. B37 (1988) 758.
11. [11] Gaussian 94, Revision D.3, M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.C. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Petersson, J.A. Montgomery, K. Raghavachari, M.A. Al-Laham, V.G. Zakrzewski, J.V. Ortiz, J.B. Foresman, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. DeFrees, J. Baker, J.J.P. Stewart, M. Head-Gordon, C. Gonzalez and J.A. Pople, Gaussian, Inc., Pittsburgh, PA, 1995.
12. [12] Y. Yamaguchi, M.J. Frisch, J.F. Gaw, H.F. Schaefer III, J.S. Binkley, J. Chem. Phys. 89 (1986) 833.