Relativistic all electron configuration interaction calculation of ground and excited states of the gold hydride molecule
- 1 December 1989
- journal article
- research article
- Published by Springer Nature in The European Physical Journal D
- Vol. 13 (4) , 363-375
- https://doi.org/10.1007/bf01398903
Abstract
No abstract availableKeywords
This publication has 30 references indexed in Scilit:
- Relativistic effects in bonding and dipole moments for the diatomic hydrides of the sixth-row heavy elementsPhysical Review A, 1988
- Relativisticab initioCI study of theX1Σ+andA1Σ+states of the AgH moleculePhysica Scripta, 1987
- Ab initio fully relativistic molecular calculations: bonding in gold hydrideProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1986
- Ab initio calculations including relativistic effects for diatomic silver, diatomic gold, silver-gold (AgAu), silver hydride (AgH), and gold hydride (AuH)The Journal of Physical Chemistry, 1985
- Relativistic effective potential SCF calculations of AgH and AuHJournal of Computational Chemistry, 1985
- Nonrelativistic all electron SCF, MCSCF, and CI calculations on the AgH, AuH, and Ag2 moleculesThe Journal of Chemical Physics, 1983
- Relativistic effects on R e and D e in AgH and AuH from all-electron Dirac–Hartree–Fock calculationsThe Journal of Chemical Physics, 1982
- Relativistic effects on bondingThe Journal of Chemical Physics, 1981
- A b i n i t i o studies of AuH, AuCl, HgH and HgCl2 using relativistic effective core potentialsThe Journal of Chemical Physics, 1978
- Dirac-Fock one-centre calculations. The molecules CuH, AgH and AuH including p-type symmetry functionsChemical Physics Letters, 1976