Counterpoise corrections to the interaction energy components in bimolecular complexes
- 1 October 1985
- journal article
- Published by Springer Nature in Theoretical Chemistry Accounts
- Vol. 68 (4), 271-283
- https://doi.org/10.1007/bf00527535
Abstract
No abstract availableKeywords
This publication has 25 references indexed in Scilit:
- Guidelines for development of basis sets for the first‐order intermolecular interaction energy calculationsJournal of Computational Chemistry, 1983
- A self-consistent field interaction energy decomposition study of 12 hydrogen-bonded dimersThe Journal of Physical Chemistry, 1983
- Improved SCF interaction energy decomposition scheme corrected for basis set superposition effectInternational Journal of Quantum Chemistry, 1983
- Energy Decomposition Analysis of Molecular InteractionsPublished by Springer Nature ,1981
- Possible improvements of the interaction energy calculated using minimal basis setsTheoretical Chemistry Accounts, 1979
- An energy decomposition scheme applicable to strongly interacting systemsTheoretical Chemistry Accounts, 1978
- A new energy decomposition scheme for molecular interactions within the Hartree‐Fock approximationInternational Journal of Quantum Chemistry, 1976
- Weak intermolecular interactionTheoretical Chemistry Accounts, 1975
- Molecular Orbital Studies of Hydrogen Bonds. III. C=O···H–O Hydrogen Bond in H2CO···H2O and H2CO···2H2OThe Journal of Chemical Physics, 1971
- The calculation of small molecular interactions by the differences of separate total energies. Some procedures with reduced errorsMolecular Physics, 1970