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Ab initio static polarizability and first hyperpolarizability of model polymethine chains. II....
- Source :
- Journal of Chemical Physics; 10/1/1997, Vol. 107 Issue 13, p5076, 12p, 6 Charts, 7 Graphs
- Publication Year :
- 1997
-
Abstract
- Focuses on an ab initio coupled Hartree-Fock study carried out on polymethineimine (PMI) oligomers with an increasing number of unit cells. Effect of conformational differences; End-capping by a strong donor-accepted pair; Static electronic longitudinal polarizability; Computation of first hyperpolarizability.
- Subjects :
- HARTREE-Fock approximation
OLIGOMERS
Subjects
Details
- Language :
- English
- ISSN :
- 00219606
- Volume :
- 107
- Issue :
- 13
- Database :
- Complementary Index
- Journal :
- Journal of Chemical Physics
- Publication Type :
- Academic Journal
- Accession number :
- 4247339
- Full Text :
- https://doi.org/10.1063/1.474892