Nature of chemical bonds in MCCH (M=Li, Na, K) based on the topological analysis of electron localisation function (ELF) and electron density

Chemical Physics Letters

Volumn 331, Issue 5-6, 2000, Pages 538-546

  Mierzwicki, Krzysztof ^a   Berski, Slawomir ^a   Latajka, Zdzislaw ^a  

^a UNIVERSITY OF WROC AW   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001441445     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)01184-2     Document Type: Article

References (29)

1. Veillard A. J. Chem. Phys. 48:1968;2012.
2. Streitwieser A. Jr., Williams J. Jr., Alexandratos S., McKelvey J.M. J. Am. Chem. Soc. 98:1976;4778.
3. Hinchliffe A. J. Mol. Struct. 37:1977;145.
4. Bachrach S.M., Streitwieser A. Jr. J. Am. Chem. Soc. 106:1984;2284.
5. A. Streitwieser, S.M. Bachrach, A. Dorigo, P.v.R. Schleyer, in: A.M. Sapse, P.v.R. Schleyer (Eds.), Lithium Chemistry: A Theoretical and Experimental Overview, Wiley, New York, 1995.
6. Goldfuss B., Schleyer P.v.R., Hampel F. J. Am. Chem. Soc. 119:1997;1072.
7. Apponi A.J., Brewster M.A., Ziurys L.M. Chem. Phys. Lett. 298:1998;161.
8. Silvi B., Savin A. Nature. 371:1994;683.
9. Bader R.F.W. Atoms in Molecules: A Quantum Theory. 1990;Oxford University Press, Oxford.
10. Grotjahn D.B., Apponi A.J., Brewster M.A., Xin J., Ziurys L.M. Angew. Chem. Int. Ed. Engl. 37:1998;2678.
11. Scalmani G., Bredas J.L., Barone V. J. Chem. Phys. 112:2000;1178.
12. Gauss J., Stanton J.F. Int. J. Quant. Chem. 77:2000;305.
13. M.J. Frisch, et al., GAUSSIAN 98, Gaussian, Inc., Pittsburgh, PA, 1998.
14. AIMPAC, R.F.W. Bader, McMaster University, Hamilton, Ont., Canada, L8S 4M1 (contact: bader@mcmail.cis.mcmaster.ca).
15. Noury S., Krokidis X., Fuster F., Silvi B. TopMod package. 1998;Université Pierre et Marie Curie, Paris.
16. C. VanAlsenoy, J.M.L. Martin, gar2ped utility program.
17. Becke A.D., Edgecombe K.E. J. Chem. Phys. 92:1990;5397.
18. Savin A., Silvi B., Colonna F. Can. J. Chem. 74:1996;1088.
19. Bader R.F.W., Stephens M.E. Chem. Phys. Lett. 26:1974;445.
20. Noury S., Krokidis X., Fuster F., Silvi B. Comput. Chem. 23:1999;597.
21. Cremer D., Kraka E. Angew. Chem. Int. Ed. Engl. 8:1984;627.
22. Steiner T. J. Chem. Soc. Chem. Commun. 1995;95.
23. Noury S., Colonna F., Savin A., Silvi B. J. Mol. Struct. 450:1998;59.
24. J. Panek, Z. Latajka, Chem. Phys. Lett., in press.
25. Berski S., Silvi B., Latajka Z., Leszczyski J. J. Chem. Phys. 111:1999;2542.
26. S. Berski, B. Silvi, J. Lundell, S. Noury, Z. Latajka, in: C. Minot, Y.G. Smeyes, S. Wilson, R. McWeeny, J. Maruani (Eds.), Progress in Theoretical, Kluwer, Dordrecht, in press.
27. NBO 4.0. E.D. Glendening, J.K. Badenhoop, A.E. Reed, J.E. Carpenter, F. Weinhold, Theoretical Chemistry Institute, University of Wisconsin, Madison, WI, 1996.
28. Lambert C., Kaupp M., Schleyer P.v.R. Organometallics. 91:1993;853.
29. Allred A.L., Rochow E.G. J. Inorg. Nucl. Chem. 5:1979;264.