We investigate influence of variations of anharmonic constants on vibrational energies obtained by the configuration interaction, self-consistent and perturbational methods.
We investigate influence of variations of anharmonic constants on vibrational energies obtained by the configuration interaction, self-consistent and perturbational methods. (en)
Byla systematicky testována numerická stabilita poruchových a SCF metod pro výpočet vibračních energií molecul. (cs)