Frequency dependent equation-of-motion coupled cluster hyperpolarizabilities: Resolution of the...

Autor: Rozyczko, Piotr, Bartlett, Rodney J.
Předmět:
Zdroj: Journal of Chemical Physics; 12/22/1997, Vol. 107 Issue 24, p10823, 4p, 2 Charts
Abstrakt: Discusses the frequency dependent equation-of-motion coupled cluster (EOM-CC) hyperpolarizabilities. Static and dynamic hyperpolarizabilities of the Hartree-Fock molecule; Overview on the EOM-CC approach; Dispersion correction given by EOM CCSD.
Databáze: Complementary Index