Electric and magnetic properties of hexaethynylbenzene

Molecular Physics

Volumn 96, Issue 7, 1999, Pages 1099-1108

  Fowler, P W ^a   Steiner, E ^a   Zanasi, R ^b   Cadioli, B ^b  

^a UNIVERSITY OF EXETER   (United Kingdom)

^b UNIVERSITY OF MODENA AND REGGIO EMILIA   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000226774     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268979909483052     Document Type: Article

References (32)

1. Diercks, R., Armstrong, J. C., Boese, R., and Vollhardt, K. P. C., 1986. Angew. Chem. Int. Ed. Engl., 25:268
2. Chandrasekhar, J., Jemmis, E. D., and Schleyer, P. von R., 1979. Tetrahedron, 39:3707
3. Schleyer, P. von R., Jiao, J., Glukhovtsev, M. N., Chandrasekhar, J., and Kraka, E., 1994. J. Am. chem. Soc., 116:10129
4. El-Shall, M. S., and Vollhardt, K. P. C., 1989. J. molec. Structure, 183:175 (Theochem.)
5. Lazzeretti, P., Malagoli, M., and Zanasi, R., 1991. J. molec. Structure, 234:127 (Theochem.)
6. Amos, R. D., and Rice, J. E., 1987. The Cambridge Analytical Derivatives Package, issue 4.0.
7. Lazzeretti, P., and Zanasi, R., 1980. SYSMO package (Italy:University of Modena). Some additional routines for evaluation and plotting of current density were written in Exeter.
8. Fowler, P. W., and Steiner, E., 1997. J. phys. Chem., 101:1409
9. McWeeny, R., 1961. Phys. Rev., 126:1028
10. Diercksen, G., and McWeeny, R., 1966. J. chem. Phys., 44:3554
11. McWeeny, R., 1971. Chem. Phys. Lett., 9:341
12. Lazzeretti, P., and Zanasi, R., 1985. Phys. Rev. A, 32:2607
13. Sadlej, A. J., 1976. Acta Phys. Polon., A49:666
14. London, F., 1937. J. Phys. Radium, 8:397
15. Edwards, T. G., and McWeeny, R., 1971. Chem. Phys. Lett., 10:283
16. Ditchfield, R., 1974. Molec. Phys., 27:789
17. Kutzelnigg, W., 1980. Israel J. Chem., 19:193
18. Schindler, M., and Kutzelnigg, W., 1982. J. chem. Phys., 76 1919
19. Keith, T. A., and Bader, R. F. W., 1993. J. chem. Phys., 99:3669
20. Zanasi, R., 1996. J. chem. Phys., 105:1460
21. Keith, T. A., and Bader, R. F. W., 1993. Chem. Phys. Lett., 210:223
22. Lazzeretti, P., Malagoli, M., and Zanasi, R., 1994. Chem. Phys. Lett., 220:299
23. Coriani, S., Lazzeretti, P., Malagoli, M., and Zanasi, R., 1994. Theoret. Chim. Acta, 89:181
24. Zanasi, R., Lazzeretti, P., Malagoli, M., and Piccinini, F., 1995. J. chem. Phys., 102:7150
25. Lazzeretti, P., and Zanasi, R., 1996. Int. J. quantum Chem., 60:249
26. Lazzeretti, P., Malagoli, M., and Zanasi, R., 1995. J. chem. Phys., 102:9619
27. Appleman, B. R., and Dailey, B. P., 1974. Adv. Magn. Res., 7:23
28. Gierke, T. D., and Flygare, W., 1972. J. Am. chem. Soc., 94:7277
29. Hoarau, J., Lumbroso, N., and Pacault, N., 1956. CR Acad. Sci., 242:1702 (Paris)
30. Jameson, A. K., and Jameson, C. J., 1987. Chem. Phys. Lett., 134:461
31. Fowler, P. W., Zanasi, R., Cadioli, B., and Steiner, E., 1996. Chem. Phys. Lett., 251:132
32. Dosa, P., and Vollhardt, K. P., 1998. private communication.