๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Ab initio CI calculation of the generalized oscillator strength for four transitions of the CO molecule

โœ Scribed by Lek Chantranupong; Gerhard Hirsch; K Bhanuprakash; Robert J. Buenker; Mineo Kimura; Michael A. Dillon


Publisher
Elsevier Science
Year
1992
Tongue
English
Weight
754 KB
Volume
164
Category
Article
ISSN
0301-0104

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Ab Initio Calculation of the Electronic
โœ Ikhlas Drira ๐Ÿ“‚ Article ๐Ÿ“… 1999 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 142 KB

Ab initio MRCI electronic dipole transition moments were calculated for the singlet and triplet molecular states contributing to free-free and free-bound absorption in the far wings of the Lyman โฃ and Lyman โค lines of hydrogen atom perturbed by another hydrogen atom in its ground state. Results are

Near ab-initio methods for the calculati
โœ Roman Osman; Harel Weinstein ๐Ÿ“‚ Article ๐Ÿ“… 1977 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 571 KB

Results from pseudopotential calculations on S-hydroxyindole, tryptamine, 5-hydroxytryptamine, 6-hydroxytryptamine and the imidazolium cation are compared to full ab-initio calculations. The localization of all molecular orbitals is found to be identical with the two methods. Orbital energies from t