Coupled-cluster calculations of Raman intensities and their application to N4 and N5−
- 3 December 1999
- journal article
- Published by Elsevier in Chemical Physics Letters
- Vol. 314 (3-4) , 381-387
- https://doi.org/10.1016/s0009-2614(99)01186-0
Abstract
No abstract availableKeywords
This publication has 30 references indexed in Scilit:
- Raman intensities from Kohn–Sham calculationsThe Journal of Chemical Physics, 1996
- Applications of Post‐Hartree—Fock Methods: A TutorialReviews in Computational Chemistry, 1994
- The equation of motion coupled-cluster method. A systematic biorthogonal approach to molecular excitation energies, transition probabilities, and excited state propertiesThe Journal of Chemical Physics, 1993
- Molecular hyperpolarizabilitiesThe Journal of Chemical Physics, 1993
- Ab initiopolarizability derivatives for methane: an application to Raman intensities of overtone and combination bandsMolecular Physics, 1991
- Raman SpectroscopyPublished by Springer Nature ,1990
- Calculation of polarizability derivatives using analytic gradient methodsChemical Physics Letters, 1986
- Analytic Raman intensities from molecular electronic wave functionsThe Journal of Chemical Physics, 1986
- An efficient a b i n i t i o method for computing infrared and Raman intensities: Application to ethyleneThe Journal of Chemical Physics, 1979
- Calculation of Raman scattering parameters for methane and halomethanes from an atom dipole interaction modelThe Journal of Chemical Physics, 1977