Published December 15, 1979 | Version v1
Journal article

Study of the ground states and ionization energies of H2, C2, N2, F2, and CO molecules by the variational cellular method

  • 1. Instituto de Fisica, Universidade de Sao Paulo, Caixa Postal 20516, Sao Paulo, Brasil

Description

Self-consistent calculations for the ground state potential curves and ionization energies are reported for the molecules H2, C2, N2, F2, and CO, using the recent proposed variational cellular method. For all these molecules the results are quite good. The calculated binding energies, equilibrium interatomic distances, and energy ionization spectra are in excellent agreement with the available experimental findings

Additional details

Publishing Information

Journal Title
J. Chem. Phys.
Journal Volume
71
Journal Issue
12
Series
J. Chem. Phys.
Journal Page Range
4923-4930
ISSN
0021-9606

INIS

Country of Publication
United States
Country of Input or Organization
United States
INIS RN
11518922
Subject category
S74: ATOMIC AND MOLECULAR PHYSICS;
Resource subtype / Literary indicator
Numerical Data
Descriptors DEI
CARBON; CARBON MONOXIDE; FLUORINE; GROUND STATES; HYDROGEN; IONIZATION POTENTIAL; NITROGEN; SELF-CONSISTENT FIELD
Descriptors DEC
CARBON COMPOUNDS; CARBON OXIDES; CHALCOGENIDES; ELEMENTS; ENERGY LEVELS; HALOGENS; NONMETALS; OXIDES; OXYGEN COMPOUNDS