Complete to second-orderab initio level calculations of electronicg-tensors
- 1 May 1996
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 93 (5) , 259-267
- https://doi.org/10.1007/bf01127505
Abstract
No abstract availableKeywords
This publication has 28 references indexed in Scilit:
- Ab initio study of molecular g‐tensorsInternational Journal of Quantum Chemistry, 1995
- Gauge-invariant basis sets for magnetic property calculationsThe Journal of Chemical Physics, 1995
- Ab initio calculations of g values of free radicals by finite perturbation theoryJournal of Molecular Structure: THEOCHEM, 1991
- Calculation of molecular g tensors. Comparison of Rayleigh-Schrödinger and Hartree-Fock perturbation theoryChemical Physics, 1990
- Contribution of the relativistic mass correction to the g tensor of moleculesChemical Physics, 1989
- Approximate Molecular Orbital Theory of Nuclear and Electron Magnetic Resonance ParametersPublished by Springer Nature ,1977
- Theory of high-precision Zeeman effect in diatomic moleculesJournal of Molecular Spectroscopy, 1976
- Energy weighted maximum overlap in magnetic fields applications to electron spin resonance problemsInternational Journal of Quantum Chemistry, 1975
- The calculation of spin-orbit splitting and g tensors for small molecules and radicalsProceedings of the Royal Society of London. Series A. Mathematical and Physical Sciences, 1973
- Calculation of g Values for O3−, NO22−, and NF2The Journal of Chemical Physics, 1972