One-Electron Properties of Near-Hartree–Fock Wavefunctions. I. Water
Self-consistent-field calculations are reported for the ground state of the water molecule in a contracted and uncontracted Gaussian basis set. The uncontracted set is shown to ...
Publications
2 shownEthylene Molecule in a Gaussian Basis. II. Contracted Bases
A self-consistent-field calculation on ground-state ethylene was performed using a large (sp) Gaussian basis. An upper bound to the Hartree—Fock energy and a lower bound to the ...
Frequent Co-Authors
Researcher Info
- h-index
- 2
- Publications
- 2
- Citations
- 358
- Institution
- New York University
External Links
Impact Metrics
h-index
2
h-index: Number of publications with at least h citations each.