𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Coupled Hartree-Fock calculations of the electric dipole polarizability and first hyperpolarizability of some “inorganic benzenes”

✍ Scribed by P. Lazzeretti; J.A. Tossell


Book ID
113257184
Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
591 KB
Volume
236
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Coupled Hartree Fock calculation of stat
✍ A. Gupta; A. K. Bhattacharya; P. K. Mukherjee 📂 Article 📅 1974 🏛 John Wiley and Sons 🌐 English ⚖ 442 KB

## Abstract Static dipole polarizabilities and shielding factors for the 2__p__ open shell atomic systems are presented using coupled Hartree Fock theory in the framework of the Roothaan formalism. Calculations have been performed for the ground as well as for some valence excited states. A variati

Coupled Hartree-Fock calculation of the
✍ M.J. Jamieson 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 237 KB

Expressions for the diamagnetic part of the Cotton-Mouton constant and the hyperpolarizability of helium are obtained within the coupled Hartree-Fock approximation; they involve solutions of integro-differential equations which are solved numerically in a calculation of these properties. An earlier

Vibrational versus electronic first hype
✍ Benoît Champagne 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 202 KB

Hartree᎐Fock 6-31G level by using coupled Hartree᎐Fock and the double harmonic v Ž . e Ž . oscillator approximations, respectively. Although the ␤ 0 r␤ 0 ratio is slightly larger Ž . than unity and rather constant with respect to the substituent s , it turns out, for the e Ž . monosubstituted compo