Open AccessConvenient Quadratic Formulas for the Two-center Coulomb Repulsion Integrals in the Semiempirical LCAO-MO Method and the Significance of the Pariser-Parr Approximation
Author(s) -
Yasuhiko Gondo,
Yoshiya Kanda
Publication year - 1972
Publication title -
bulletin of the chemical society of japan
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 1.145
H-Index - 99
eISSN - 1348-0634
pISSN - 0009-2673
DOI - 10.1246/bcsj.45.1612
Subject(s) - chemistry , linear combination of atomic orbitals , excited state , dipole , quantum mechanics , center (category theory) , atomic physics , singlet state , quadratic equation , ground state , atomic orbital , physics , electron , mathematics , organic chemistry , geometry , crystallography
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