Electronic correlation and structure of fulvene in ground and excited states

Author:

Tyutyulkov N. N.,Neikov G. D.,Kynev I. N.

Publisher

Springer Science and Business Media LLC

Subject

General Chemistry

Reference20 articles.

1. A. A. Ovchinnikov, I. I. Ukrainskii, and G. F. Kventsel', ?Theory of unidimensional Mott semiconductors and electronic structure of long molecules with conjugated bonds,? Usp. Fiz. Nauk, 108, No. 1, 81 (1972).

2. V. A. Kuprievich and O. V. Shramko, ?Use of the multiconfigurational self-consistent-field theory for conjugated systems,? Teor. Eksp. Khim., 7, No. 6, 738?746 (1971).

3. V. A. Kuprievich, V. E. Klimenko, and O. V. Shramko, ?Symmetric and localized solutions of equations of the multiconfigurational self-consistent-field theory for even-numbered polyenes,? Teor. Eksp. Khim., 12, No. 5, 678?680 (1976).

4. V. A. Kuprievich, V. E. Klimenko, and O. V. Shramko, ?Relation of the correlation energy of even-numbered polyenes to the length of the carbon chain,? Teor. Eksp. Khim., 12, No. 6, 732?738 (1976).

5. N. A. Miskurkinand and A. A. Ovchinnikov, ?Method for completely taking into account electron interaction during use of a limited basis of atomic functions,? Opt. Spektrosk., 24, No. 6, 849?859 (1968).

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