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Effective dipole moment of rotational transitions ofX2Ymolecules

โœ Scribed by V. I. Starikov


Book ID
110127804
Publisher
SP MAIK Nauka/Interperiodica
Year
2001
Tongue
English
Weight
91 KB
Volume
91
Category
Article
ISSN
0030-400X

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๐Ÿ“œ SIMILAR VOLUMES


Efficient calculation of vibrational mag
โœ R.D. Amos; N.C. Handy; K.J. Jalkanen; P.J. Stephens ๐Ÿ“‚ Article ๐Ÿ“… 1987 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 414 KB

A priori prediction of vibrational magnetic dipole transition moments and vibrational strengths requires the calculation of the overlap integral of the derivatives of the electronic wavefunction with respect to nuclear displacement and an external magnetic field. The efficient calculation of this in