Wyniki wyszukiwania dla: CORRELATION METHODS
Filtry
wszystkich: 708
wybranych: 1
-
Katalog
Filtry wybranego katalogu
Wyniki wyszukiwania dla: CORRELATION METHODS
-
Full CI ground state potential energy curves and one-electron relativistic corrections for hydrogen molecule in various basis sets
Dane BadawczeThis dataset consists of Full CI ground state Born-Oppenheimer potential energy curves and one-electron relativistic corrections for hydrogen dimer. Nonrelativistic energies, as well as one electron relativistic corrections (treated perturbatively with help of the Cowan-Griffin Hamiltonian) are presented for internuclear distances between 0.8 and 10...