LCAO—MO–SCF Calculations on LiH Using Gaussian Basis Set
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.1726952
Reference11 articles.
1. Gaussian Wavefunctions for the 10‐Electron Systems. II. Hydrogen Fluoride
2. Use of Gaussian Functions in the Calculation of Wavefunctions for Small Molecules. I. Preliminary Investigations
3. Electronic Structure of LiH and Quadrupole Moment of Li7
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1. The reconciliation of FSGO and SCF methods, and evaluation of the Hartree—Fock energy limit by using entirely the FSGO method;Journal of Molecular Structure: THEOCHEM;1995-01
2. Omega function for molecular systems: lithium hydride;Journal of Molecular Structure;1986-03
3. The scope for small Gaussian bases in molecular energy calculation;Theoretical and Experimental Chemistry;1984
4. Explicitly correlated configuration interaction studies using spherical Gaussians. II. Exploratory studies on LiH;International Journal of Quantum Chemistry;1982-07
5. The effects of electron correlation on the adiabatic correction and on equilibrium constants for isotopic exchange reactions;The Journal of Chemical Physics;1978
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