NASA NTRS · 19880040718
Core-core and core-valence correlation
Abstract
The effect of 1s core correlation on properties and energy separations are analyzed using full configuration-interaction (FCI) calculations. The Be1S - 1P, the C 3P - 5S,m and CH(+) 1Sigma(+) - 1Pi separations, and CH(+) spectroscopic constants, dipole moment, and 1Sigma(+) - 1Pi transition dipole moment have been studied. The results of the FCI calculations are compared to those obtained using approximate methods.
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Bauschlicher, Charles W., Jr., Langhoff, Stephen R., Taylor, Peter R.. 1988-02-15. Core-core and core-valence correlation. https://ntrs.nasa.gov/citations/19880040718
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