AB INITIO ANALYTIC FORCE CONSTANT USING SPHERICAL GAUSSIAN FUNCTION

DOI10.1142/S0129183102003139zbMath1081.81577MaRDI QIDQ3368587

M. Solimannejad, A. H. Pakiari

Publication date: 31 January 2006

Published in: International Journal of Modern Physics C (Search for Journal in Brave)

zbMATH Keywords

diatomic moleculesGaussian functionsecond derivativeforce constant

Mathematics Subject Classification ID

Software, source code, etc. for problems pertaining to quantum theory (81-04) Coherent states (81R30) Molecular physics (81V55)

Cites Work

• The electrostatic calculation of molecular energies - I. Methods of calculating molecular energies