An MO-theoretical calculation of solvent effect upon the NH3 + HF = NH4F reaction
- 1 January 1973
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 30 (4), 327-337
- https://doi.org/10.1007/bf00527466
Abstract
No abstract availableKeywords
This publication has 19 references indexed in Scilit:
- CNDO/2 calculations and configuration analyses for some hydrogen-bonded systemsTheoretical Chemistry Accounts, 1972
- The influence of solvation on the calculated activation energy for the reaction CH3F+F?Theoretical Chemistry Accounts, 1972
- A plausible theoretical model for the hydrated electronChemical Physics Letters, 1971
- Gaussian expansion method for molecular integrals of molecular propertiesInternational Journal of Quantum Chemistry, 1971
- Small Gaussian Expansions of Slater-Type OrbitalsThe Journal of Chemical Physics, 1970
- Self-Consistent Molecular-Orbital Methods. I. Use of Gaussian Expansions of Slater-Type Atomic OrbitalsThe Journal of Chemical Physics, 1969
- Configuration Analysis in the LCAO Molecular Orbital TheoryThe Journal of Chemical Physics, 1969
- Gaussian-Expansion Methods for Molecular IntegralsJournal of the Physics Society Japan, 1966
- Gaussian Expansions of Atomic OrbitalsJournal of the Physics Society Japan, 1966
- New Developments in Molecular Orbital TheoryReviews of Modern Physics, 1951