Information Technology Reference
In-Depth Information
33. Bickelhaupt, F. M.; Van Eikema Hommes, N. J. R.; Fonseca Guerra, C.; and Baerends,
E. J.; Organometallics.
The Carbon-Lithium Electron Pair Bond in (CH3Li)n (n = 1,
2, 4).
1996,
15,
2923-2931.
34. Pariser, R.; and Parr, R. G.; A semi-empirical theory of the electronic spectra and elec-
tronic structure of complex unsaturated molecules.
J. Chem. Phys.
1953,
21,
466-71.
35. Pople, J. A.; Electron interaction in unsaturated hydrocarbons.
Trans. Faraday Soc.
1953,
49,
1375-85.
36. Hasanein, A. A.; and Evans, M. W.; Computational Methods in Quantum Chemistry:
Quantum Chemistry. Singapore: World Scientific;
1996,
2
.
37. McWeeny, R.; The valence-bond theory of molecular structure. III. Cyclobutadiene
and benzene.
Proc. R. Soc. Lond. A.
1955,
227,
288-312.
38. Lowdin, P. O.; Quantum theory of cohesive properties of solids.
Adv. Phys.
1956,
5,
1-172.
39. Parr, R. G.; Quantum Theory of Molecular Electronic Structure. New York: W. A.
Benjamin, Inc.;
1963
.
40. Pople, J. A.; Reply to a letter by H. F. Hameka.
J. Chem. Phys.
1962,
37,
3009-3009.
41. Fischer-Hjalmars, I.; Deduction of the zero differential overlap approximation from
an orthogonal atomic orbital basis.
J. Chem. Phys
.
1965,
42,
1962-1972.
42. Geerlings, P.; Proft, F. De; and Langenaeker, W.; Conceptual density functional theory.
Chem. Rev.
2003,
103,
1793-1874.
43. AcuraHuckel; Version 1.2, Acurasoft Huckel Program. Acurasoft.
2009
.
http://www.acurasoft.com
44. ArgusLab; 4.0 Mark A. Thompson Planaria Software LLC. Seattle, WA;
2010
.
http://www.arguslab.com
Search WWH ::
Custom Search