Multiconfiguration self-consistent field and multireference configuration interaction methods and applications.
Laboratory for Theoretical Chemistry, Institute of Chemistry, Eötvös Loránd University, P. O. Box 32, H-1518 Budapest, Hungary. szalay@chem.elte.hu
Péter G
PG
Szalay
Thomas
T
Müller
Gergely
G
Gidofalvi
Hans
H
Lischka
Ron
R
Shepard
D000465:Algorithms; D008968:Molecular Conformation; D011789:Quantum Theory; D013816:Thermodynamics