Hartree—Fock—Slater functions as basis for one-electron perturbation calculations for molecules
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference19 articles.
1. Perturbation theory for atomic systems
2. Statistical Exchange-Correlation in the Self-Consistent Field
3. Electric Polarizability of Some Diatomic Molecules
4. Hyperpolarizabilities of Some Polar Diatomic Molecules
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1. Les fonctions de Hartree-Fock-Slater Comme Base Pour des Calculs de Perturbation À un Électron Pour Molécules. II. L'Advantage de la Formulation Dipôle Vitesse-Dipôle Longeur Pour la Polarisabilité de L'état Fondamental;Bulletin des Sociétés Chimiques Belges;2010-09-01
2. The use of the hartree-fock-slater eigenvalues to estimate excitation and ionization energies in sulfur-nitrogen compounds;International Journal of Quantum Chemistry;2009-07-09
3. Natural Chiroptical Spectroscopy: Theory and Computations;Advances in Chemical Physics;2007-03-14
4. The Generator Coordinate Method and Connections with Natural Orbitals and Density Functional Theory;Electronic, Atomic and Molecular Calculations;2007
5. The 1994 Alcan Award Lecture Density functional theory as a practical tool in studies of organometallic energetics and kinetics. Beating the heavy metal blues with DFT;Canadian Journal of Chemistry;1995-06-01
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