Level set topology of the nuclear charge space and the electronic energy functional.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 101, doi. 10.1002/qua.560220111
- By:
- Publication type:
- Article
Works matching IS 00207608 AND DT 1982 AND VI 22 AND IP 1
Results: 20
1
2
Analytic expression of the rotation harmonics in the vibration-rotation wave function of a diatomic molecule.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 23, doi. 10.1002/qua.560220104
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- Publication type:
- Article
3
Intermolecular and intramolecular interactions calculated with ab initio perturbative configuration interaction method using strongly localized orbitals.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 169, doi. 10.1002/qua.560220115
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- Publication type:
- Article
4
Charge-transfer character of the intermolecular hydrogen bond in singlet and triplet excited electronic states of the adenine-thymine base pair.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 69, doi. 10.1002/qua.560220108
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- Publication type:
- Article
5
Applications of photochemistry in probing biological targets. Edited by A. M. Tometsko and F. W. Richards, Ann. New York Academy of Sciences, New York, N.Y., 1980. Vol. 346. Price: $88.00.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 217, doi. 10.1002/qua.560220119
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- Publication type:
- Article
6
Proton transference in hydrogen bonded systems. I. Uracil tautomerism.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 89, doi. 10.1002/qua.560220110
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- Publication type:
- Article
7
Explicitly correlated configuration interaction studies using spherical Gaussians. II. Exploratory studies on LiH.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 11, doi. 10.1002/qua.560220103
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- Publication type:
- Article
8
Electron correlation described by extended geminal models: The.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 149, doi. 10.1002/qua.560220114
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- Publication type:
- Article
9
Evaluation of positron annihilation in Beryllium.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 49, doi. 10.1002/qua.560220107
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- Publication type:
- Article
10
Computations of intermolecular interactions: Expansion of a charge-transfer energy contribution in the framework of an additive procedure. Applications to hydrogen-bonded systems.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 199, doi. 10.1002/qua.560220118
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- Publication type:
- Article
11
Announcement.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 219, doi. 10.1002/qua.560220120
- Publication type:
- Article
12
Explicitly correlated configuration interaction studies using spherical Gaussians. I. Theoretical considerations.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 1, doi. 10.1002/qua.560220102
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- Publication type:
- Article
13
Molecular point group adaptation of spin-free configurations.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 127, doi. 10.1002/qua.560220113
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- Publication type:
- Article
14
Carcinogenicity of naphthylamines: A theoretical study of the stacking interaction of 1- and 2-naphthylnitrenium ions with guanine, adenine, and the dinucleoside monophosphate cytidyl-(3′-5′)-guanosine.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 37, doi. 10.1002/qua.560220106
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- Publication type:
- Article
15
'Stable' quasistationary state: New solution of the time-dependent Schrödinger equation.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 191, doi. 10.1002/qua.560220117
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- Publication type:
- Article
16
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. fmi, doi. 10.1002/qua.560220101
- Publication type:
- Article
17
Application of the theory of symmetry of nonrigid molecules to the calculation of the conformational dependences of the torsional potential and dipole moment of acetone-related molecules.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 115, doi. 10.1002/qua.560220112
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- Publication type:
- Article
18
Vibronic coupling of electronic states. II. mathematical description of the model.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 31, doi. 10.1002/qua.560220105
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- Publication type:
- Article
19
Studies in Löwdin's partitioning technique in quantum theory. II. Operators T and Ω.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 183, doi. 10.1002/qua.560220116
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- Publication type:
- Article
20
Morse matrix elements: An asymptotic expansion treatment.
- Published in:
- International Journal of Quantum Chemistry, 1982, v. 22, n. 1, p. 73, doi. 10.1002/qua.560220109
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- Publication type:
- Article