Subject Index, Volume VI.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1187, doi. 10.1002/j.1097-461X.1972.tb00018.x
- Publication type:
- Article
Works matching IS 00207608 AND DT 1972 AND VI 6
Results: 165
1
2
Author Index, Volume VI.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1183, doi. 10.1002/j.1097-461X.1972.tb00017.x
- Publication type:
- Article
3
Erratum.
- Published in:
- 1972
- Publication type:
- Correction Notice
4
The Optimized Kato Lower Bound for the Convergence Radii of Rayleigh–Schrödinger Perturbation Series.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1173, doi. 10.1002/j.1097-461X.1972.tb00015.x
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- Article
5
sppa Method for Two‐Particle Green's Function of Minimum‐Basis H<sub>2</sub>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1165, doi. 10.1002/j.1097-461X.1972.tb00014.x
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- Publication type:
- Article
6
The Delocalization Correction in the Model of Loges.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1157, doi. 10.1002/j.1097-461X.1972.tb00013.x
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- Publication type:
- Article
7
A Projection Operator Method for Orbital Basis Variation.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1149, doi. 10.1002/j.1097-461X.1972.tb00012.x
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- Article
8
Heitler–London Description of H<sub>2</sub> and LiH with Variable Orbital Exponents<sup>†</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1121, doi. 10.1002/j.1097-461X.1972.tb00011.x
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- Article
9
Loge Localization Analysis of the Methane Molecule.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1113, doi. 10.1002/j.1097-461X.1972.tb00010.x
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- Publication type:
- Article
10
Modified Effective Electron Model for Calculation of the Interaction Energy of Rare Gas Atoms<sup>†</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1101, doi. 10.1002/j.1097-461X.1972.tb00009.x
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- Publication type:
- Article
11
On the Electronic Structure of the Planar Ethylene.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1087, doi. 10.1002/j.1097-461X.1972.tb00008.x
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- Publication type:
- Article
12
Optimum Hybrid Orbitals in Localized Orbitals. II. Degenerate Case*.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1077, doi. 10.1002/j.1097-461X.1972.tb00007.x
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- Publication type:
- Article
13
Derivation of the Helium Hartree–Fock Orbitals from the Resolvent of the Hydrogen Atom<sup>†</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1067, doi. 10.1002/j.1097-461X.1972.tb00006.x
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- Publication type:
- Article
14
On the Use of Rayleigh–Schrödinger Perturbation Theory for the Calculations of Interatomic and Intermolecular Exchange Interactions.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1057, doi. 10.1002/j.1097-461X.1972.tb00005.x
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- Publication type:
- Article
15
Natural Spin Orbitals and Geminals for the Lithium <sup>2</sup>S Ground State<sup>‡</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1019, doi. 10.1002/j.1097-461X.1972.tb00003.x
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- Publication type:
- Article
16
Simple Construction of Point Group Degenerate Wave Functions.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1011, doi. 10.1002/j.1097-461X.1972.tb00002.x
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- Publication type:
- Article
17
Convergence Radii for the Perturbation Expansions of the Energy and of the Wave Function: The Case of the Delta Function Model of H<sub>2</sub><sup>+</sup>.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1001, doi. 10.1002/j.1097-461X.1972.tb00001.x
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- Publication type:
- Article
18
Representations of Second Order Charge Overlap Effects in Intermolecular Forces*.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 6, p. 1045, doi. 10.1002/j.1097-461X.1972.tb00004.x
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- Publication type:
- Article
19
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. fmi, doi. 10.1002/qua.560060501
- Publication type:
- Article
20
Theoretical calculations on σ-systems. III. Alkyl halides and alkanes.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 935, doi. 10.1002/qua.560060512
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- Publication type:
- Article
21
Quasi-relativistic approximation in the SCF-MO-LCAO method.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 849, doi. 10.1002/qua.560060505
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- Publication type:
- Article
22
An alternative formalism for the method of intermediate Hamiltonians.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 989, doi. 10.1002/qua.560060516
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- Publication type:
- Article
23
A perturbed generalized eigenvalue equation for the hydrogen molecular ion.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 911, doi. 10.1002/qua.560060509
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- Publication type:
- Article
24
A theory for the construction of the irreducible representations of finite groups.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 925, doi. 10.1002/qua.560060511
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- Publication type:
- Article
25
Eigenspace manipulation in SCF theory.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 843, doi. 10.1002/qua.560060504
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- Publication type:
- Article
26
Vibrational matrix elements of the quadrupole moment functions of H<sub>2</sub>, N<sub>2</sub> and CO.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 975, doi. 10.1002/qua.560060515
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- Publication type:
- Article
27
Valence-Bond calculations and matrix elements between two tableau functions of non-orthogonal orbitals.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 899, doi. 10.1002/qua.560060508
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- Publication type:
- Article
28
The electronic states of icosahedral molecules.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 919, doi. 10.1002/qua.560060510
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- Publication type:
- Article
29
Unrestricted Hartree-Fock calculations of spin densities with orthogonalized atomic orbitals: Proton and <sup>13</sup>C hyperfine splittings in some pi hydrocarbon radicals.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 819, doi. 10.1002/qua.560060503
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- Publication type:
- Article
30
Localized orbital calculations of the bonding in SO.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 967, doi. 10.1002/qua.560060514
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- Article
31
Analysis of reduced density matrices in the co-ordinate representation. III. Electron density and correlation in the ground states of H<sub>2</sub> and the H<sub>6</sub> ring system within some approximations of the simple LCAO type.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 881, doi. 10.1002/qua.560060507
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- Publication type:
- Article
32
Studies on Rydberg orbitals. IV. Basic formulas for the one-electron perturbation calculation of molecular Rydberg excited states.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 801, doi. 10.1002/qua.560060502
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- Publication type:
- Article
33
A floating one centre perturbation treatment for H.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 949, doi. 10.1002/qua.560060513
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- Publication type:
- Article
34
Molecular-orbital calculations on transition metal complexes, charge-transfer spectra and the sequence of metal and ligand orbitals.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 5, p. 859, doi. 10.1002/qua.560060506
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- Publication type:
- Article
35
Theoretical studies of diamagnetic properties of the hydrogen molecule ion II. Effect of varying internuclear separation.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 663, doi. 10.1002/qua.560060410
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- Publication type:
- Article
36
The computation of density matrix values in configuration space.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 795, doi. 10.1002/qua.560060421
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- Publication type:
- Article
37
Generalized Rayleigh-Schrödinger perturbation theory.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 609, doi. 10.1002/qua.560060403
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- Publication type:
- Article
38
Simple perturbation and perturbation-variation treatments of the 1 sσ.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 717, doi. 10.1002/qua.560060414
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- Publication type:
- Article
39
Variational bounds for imaginary frequency polarizability and dispersion interaction constant.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 639, doi. 10.1002/qua.560060407
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- Publication type:
- Article
40
Decoupled Hartree-Fock methods. I. Calculations for atoms with orthogonalized orbitals.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 779, doi. 10.1002/qua.560060418
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- Publication type:
- Article
41
Intermediate Hamiltonians for the lithium atom.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 793, doi. 10.1002/qua.560060420
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- Publication type:
- Article
42
Accurate calculation of Fourier transform of two-center Slater orbital products.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 601, doi. 10.1002/qua.560060402
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- Publication type:
- Article
43
The Renner effect in four-atomic molecules.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 701, doi. 10.1002/qua.560060413
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- Publication type:
- Article
44
Structure electronique des complexes acide-base de Lewis. I. Structure electronique et conformation moléculaire des molécules F.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 625, doi. 10.1002/qua.560060406
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- Publication type:
- Article
45
The n-electron problem and matrices representing the symmetric groups.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 761, doi. 10.1002/qua.560060417
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- Publication type:
- Article
46
Masthead.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. fmi, doi. 10.1002/qua.560060401
- Publication type:
- Article
47
On formulas in closed form for Van Vleck expansions.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 681, doi. 10.1002/qua.560060412
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- Publication type:
- Article
48
An economic storage and processing method for two-electron integrals in.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 617, doi. 10.1002/qua.560060405
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- Publication type:
- Article
49
Molecular orbitals of zinc phthalocyanine.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 747, doi. 10.1002/qua.560060416
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- Publication type:
- Article
50
Theoretical studies of diamagnetic properties of the hydrogen molecule ion. I. Approximate variation-perturbation calculation.
- Published in:
- International Journal of Quantum Chemistry, 1972, v. 6, n. 4, p. 651, doi. 10.1002/qua.560060409
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- Publication type:
- Article