The static dipole polarizability, first and second hyperpolarizability tensors of molecules with nonlinear optical characteristics are calculated via ab initio coupled-perturbed Hartree-Fock theory. A study of the effect of basis set augmentation on the calculated properties for the nitrobenzene mol
Vibrational polarizability and hyperpolarizability of p-nitroaniline
✍ Scribed by Benoît Champagne
- Publisher
- Elsevier Science
- Year
- 1996
- Tongue
- English
- Weight
- 607 KB
- Volume
- 261
- Category
- Article
- ISSN
- 0009-2614
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