Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. fmi, doi. 10.1002/qua.560580401
- Publication type:
- Article
Works matching IS 00207608 AND DT 1996 AND VI 58 AND IP 4
Results: 12
1
2
Convergence studies in the theory of effective Hamiltonians.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 341, doi. 10.1002/(SICI)1097-461X(1996)58:4<341::AID-QUA3>3.0.CO;2-Y
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- Publication type:
- Article
3
Electronic structure of Al, P, S, and Cl impurities in silicon.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 383, doi. 10.1002/(SICI)1097-461X(1996)58:4<383::AID-QUA7>3.0.CO;2-U
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- Publication type:
- Article
4
Size consistency of an algebraic propagator approach.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 329, doi. 10.1002/(SICI)1097-461X(1996)58:4<329::AID-QUA2>3.0.CO;2-#
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- Publication type:
- Article
5
Geometry optimization and conformational analysis through generalized simulated annealing.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 373, doi. 10.1002/(SICI)1097-461X(1996)58:4<373::AID-QUA6>3.0.CO;2-V
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- Publication type:
- Article
6
A quantum-mechanical calculation of the dynamic structure factors of magnesium difluoride.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 419, doi. 10.1002/(SICI)1097-461X(1996)58:4<419::AID-QUA11>3.0.CO;2-X
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- Publication type:
- Article
7
Information entropy as a measure of the quality of an approximate electronic wave function.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 323, doi. 10.1002/(SICI)1097-461X(1996)58:4<323::AID-QUA1>3.0.CO;2-#
- By:
- Publication type:
- Article
8
The use of ab initio quantum molecular self-similarity measures to analyze electronic charge density distributions.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 361, doi. 10.1002/(SICI)1097-461X(1996)58:4<361::AID-QUA5>3.0.CO;2-W
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- Publication type:
- Article
9
Symmetry properties of inversion-bending Hamiltonian of dimethyl-amine.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 399, doi. 10.1002/(SICI)1097-461X(1996)58:4<399::AID-QUA9>3.0.CO;2-T
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- Publication type:
- Article
10
Quadratic hyperpolarizabilities of nitro-substituted pseudo-linear dye molecules with ethylenic and azo bridges.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 407, doi. 10.1002/(SICI)1097-461X(1996)58:4<407::AID-QUA10>3.0.CO;2-Z
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- Publication type:
- Article
11
A valence bond study of the oxygen molecule.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 351, doi. 10.1002/(SICI)1097-461X(1996)58:4<351::AID-QUA4>3.0.CO;2-X
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- Publication type:
- Article
12
C<sub>3</sub>H<sub>4</sub>: Theoretical study of structures and stabilities of isomers.
- Published in:
- International Journal of Quantum Chemistry, 1996, v. 58, n. 4, p. 389, doi. 10.1002/(SICI)1097-461X(1996)58:4<389::AID-QUA8>3.0.CO;2-U
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- Publication type:
- Article