Cumulative atomic multipole moments and point charge models describing molecular charge distribution
- 31 March 1989
- journal article
- Published by Elsevier in Computer Physics Communications
- Vol. 52 (3) , 397-408
- https://doi.org/10.1016/0010-4655(89)90114-8
Abstract
No abstract availableKeywords
This publication has 33 references indexed in Scilit:
- Correlated molecular and cumulative atomic multipole momentsThe Journal of Chemical Physics, 1987
- Cumulative atomic multipole representation of the molecular charge distribution and its basis set dependenceChemical Physics Letters, 1983
- Distributed multipole analysis, or how to describe a molecular charge distributionChemical Physics Letters, 1981
- Hydration scheme of uracil and cytosineTheoretical Chemistry Accounts, 1978
- Bonded-atom fragments for describing molecular charge densitiesTheoretical Chemistry Accounts, 1977
- Efficient multipole expansion: Choice of order and density partitioning techniquesTheoretical Chemistry Accounts, 1977
- Multiple expansion of molecular charge distributionJournal of the Chemical Society, Faraday Transactions 2: Molecular and Chemical Physics, 1974
- On Physical Properties and Interactions of Polyatomic Molecules: With Application to Molecular Recognition in BiologyPublished by Elsevier ,1973
- Analysis of Charge Distributions: Hydrogen FluorideThe Journal of Chemical Physics, 1964
- Electronic Population Analysis on LCAO–MO Molecular Wave Functions. IThe Journal of Chemical Physics, 1955