CALCULATION OF THE POTENTIAL ENERGY CURVES FOR THE LOWEST LYING ELECTRONIC STATES OF THE ISOVALENT DIATOMIC MOLECULES $Si_{2}, Ge_{2}, SiC$ AND GeC USING AB INITIO HF-CI METHOD

H. M. Nagarathna,Irene Shim,Karl A. Gingerich

CALCULATION OF THE POTENTIAL ENERGY CURVES FOR THE LOWEST LYING ELECTRONIC STATES OF THE ISOVALENT DIATOMIC MOLECULES $Si_{2}, Ge_{2}, SiC$ AND GeC USING AB INITIO HF-CI METHOD

1984

H. M. Nagarathna
Irene Shim
Karl A. Gingerich

Author Institution: DEPARTMENT OF PHYSICS, UNIVERSITY OF WISCONSIN-PLATTEVILLE; CHEMISTRY DEPARTMENT B, THE TECHNICAL UNIVERSITY OF DENMARK; DEPARTMENT OF CHEMISTRY, TEXAS A\&M UNIVERSITY

Keywords:

Computational chemistry
Diatomic molecule
Potential energy
Ab initio
Chemistry
technical university
electronic states
Atomic physics

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