On partitioning the overlap charge density in self-consistent charge molecular-orbital calculations.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 67, doi. 10.1002/qua.560030110
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- Publication type:
- Article
Works matching IS 00207608 AND DT 1969 AND VI 3 AND IP 1
Results: 19
1
2
Exposé d'une méthode de détermination des orbitales virtuelles pour les interactions de configurations.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 3, doi. 10.1002/qua.560030103
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- Publication type:
- Article
3
Compact natural orbital expansions for the helium ground state.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 107, doi. 10.1002/qua.560030114
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- Article
4
A semiempirical SCF- LCAO- MO treatment of some oxygen- and nitrogen-containing heterocyclic molecules.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 33, doi. 10.1002/qua.560030107
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- Publication type:
- Article
5
Best lower bounds for the convergence radius of RS-perturbation theory.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 141, doi. 10.1002/qua.560030118
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- Publication type:
- Article
6
Free-electron model for anisotropy of π-electron polarizability in benzene.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 1, doi. 10.1002/qua.560030102
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- Publication type:
- Article
7
Etudes en methode de Hartree-Fock avec projection. I. Fonctions propres de S<sup>2</sup>. Evaluation de l'energie.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 93, doi. 10.1002/qua.560030113
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- Publication type:
- Article
8
A remark on the Born-Oppenheimer approximation.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 25, doi. 10.1002/qua.560030106
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- Publication type:
- Article
9
Zur konstruktion von energiehyperflächen.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 131, doi. 10.1002/qua.560030117
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- Article
10
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. fmi, doi. 10.1002/qua.560030101
- Publication type:
- Article
11
The first excited triplet states of the nucleotide bases calculated with different semiempirical SCF schemes.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 79, doi. 10.1002/qua.560030112
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- Publication type:
- Article
12
Transition probability and oscillator strength by perturbation theory: 1 s3 p<sup>1,3</sup> P−1 s3 d<sup>1,3</sup> D transition in helium isoelectronic sequence.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 17, doi. 10.1002/qua.560030105
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- Publication type:
- Article
13
Zur eindeutigkeit der darstellungen von energiehyperflachen.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 123, doi. 10.1002/qua.560030116
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- Publication type:
- Article
14
Error bounds for the overlap of approximate wave functions.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 57, doi. 10.1002/qua.560030109
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- Publication type:
- Article
15
Une theorie adiabatique de la relaxation spin-reseau.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 73, doi. 10.1002/qua.560030111
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- Publication type:
- Article
16
Accurate variational calculation of upper and lower bounds of dispersion interaction constant of two hydrogen atoms.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 13, doi. 10.1002/qua.560030104
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- Publication type:
- Article
17
Wellenmechanische absolutrechnung am HeHHe<sup>+</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 115, doi. 10.1002/qua.560030115
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- Publication type:
- Article
18
Configuration interaction study of H<sub>2</sub> and H<sub>3</sub> systems.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 45, doi. 10.1002/qua.560030108
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- Publication type:
- Article
19
Announcments.
- Published in:
- International Journal of Quantum Chemistry, 1969, v. 3, n. 1, p. 145, doi. 10.1002/qua.560030119
- Publication type:
- Article