Electronic structure calculations of 1,3-dipolar cycloadditions using density functional and Hartree-Fock methods-Reference-Cited by-同舟云学术

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Electronic structure calculations of 1,3-dipolar cycloadditions using density functional and Hartree-Fock methods

Published:1994-02-05 Issue:4 Volume:49 Page:511-526
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Sosa Carlos,Andzelm Jan,Lee Chengteh,Blake James F.,Chenard B. L.,Butler Todd W.

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Reference92 articles.

1. and Density-Functional Theory of Atoms and Molecules (Oxford University Press, New York, 1989).

2. Universal variational functionals of electron densities, first-order density matrices, and natural spin-orbitals and solution of the v-representability problem

3. Approximate density functional theory as a practical tool in molecular energetics and dynamics

4. ACS Symposium;Becke,1989

5. The density functional formalism, its applications and prospects

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