A finite-difference solution of the Hartree-Fock equations for diatomic molecules.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 301, doi. 10.1002/qua.560090210
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 1975 AND VI 9 AND IP 2
Results: 12
1
2
A first-principle pseudopotential calculation of the ( ns) energy levels of the K atom. II.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 215, doi. 10.1002/qua.560090203
- By:
- Publication type:
- Article
3
Theoretical investigation of the π -electronic structure and spectra of protonated aromatic carbonyl compounds.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 261, doi. 10.1002/qua.560090207
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- Publication type:
- Article
4
Electrostatic molecular potentials: Mulliken approximation.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 193, doi. 10.1002/qua.560090202
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- Publication type:
- Article
5
Computation of Fourier transform quantities in Hartree-Fock calculations for simple crystals.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 243, doi. 10.1002/qua.560090206
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- Publication type:
- Article
6
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. fmi, doi. 10.1002/qua.560090201
- Publication type:
- Article
7
Square well model and the functional form for the resonance integral.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 379, doi. 10.1002/qua.560090212
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- Publication type:
- Article
8
Conditional probability amplitudes in wave mechanics.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 237, doi. 10.1002/qua.560090205
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- Publication type:
- Article
9
The electronic structure of the excited states for B, C<sup>+</sup>, and C arising from the configuration 1 s<sup>2</sup> 2 s 2 p<sup> n</sup>-the effect of removal of the 'equivalence' restriction.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 287, doi. 10.1002/qua.560090209
- By:
- Publication type:
- Article
10
Nonrigid molecule effects in molecules with linear or nongeometrically equivalent equilibrium configurations.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 325, doi. 10.1002/qua.560090211
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- Publication type:
- Article
11
Møller-Plesset theory for atomic ground state energies.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 229, doi. 10.1002/qua.560090204
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- Publication type:
- Article
12
A correlation study of Li ground state by the MCHF procedure.
- Published in:
- International Journal of Quantum Chemistry, 1975, v. 9, n. 2, p. 273, doi. 10.1002/qua.560090208
- By:
- Publication type:
- Article