Revanth Kodoru, Atanu Saha, et al.
arXiv
Computations of total molecular energies, dissociation energies, and electric dipole moments for the ground states of the molecules LiF, BeO, BF, CO, MgO, AlF, SiO, PN, CaO, SrO, HCN, FHF–, CO2, N2O, OCN–, FCN, SCO, SCN–, C1CN, FCCH, C1CCH, NCCCH are reported. The results come close to the Hartree‐Fock limit, and their accuracy is critically discussed. A detailed discussion of the Slater‐type orbital (STO) basis sets used for the computations is given. Copyright © 1967 John Wiley & Sons, Inc.
Revanth Kodoru, Atanu Saha, et al.
arXiv
Fernando Marianno, Wang Zhou, et al.
INFORMS 2021
Michael Ray, Yves C. Martin
Proceedings of SPIE - The International Society for Optical Engineering
R.D. Murphy, R.O. Watts
Journal of Low Temperature Physics