Natural Energy Decomposition Analysis: The Linear Response Electrical Self Energy
- 1 January 1996
- journal article
- Published by American Chemical Society (ACS) in The Journal of Physical Chemistry
- Vol. 100 (43) , 17152-17156
- https://doi.org/10.1021/jp9612994
Abstract
No abstract availableKeywords
This publication has 21 references indexed in Scilit:
- Dication−Water Interactions: M2+(H2O)n Clusters for Alkaline Earth Metals M = Mg, Ca, Sr, Ba, and RaThe Journal of Physical Chemistry, 1996
- Natural Energy Decomposition Analysis: Explicit Evaluation of Electrostatic and Polarization Effects with Application to Aqueous Clusters of Alkali Metal Cations and NeutralsJournal of the American Chemical Society, 1996
- Cation−Ether Complexes in the Gas Phase: Bond Dissociation Energies and Equilibrium Structures of Li+[O(CH3)2]x, x = 1−4The Journal of Physical Chemistry, 1996
- Cation-Water Interactions: The M+(H2O)n Clusters for Alkali Metals, M = Li, Na, K, Rb, and CsThe Journal of Physical Chemistry, 1995
- An Ab Initio Investigation of the Structure and Alkali Metal Cation Selectivity of 18-Crown-6Journal of the American Chemical Society, 1994
- General atomic and molecular electronic structure systemJournal of Computational Chemistry, 1993
- Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functionsThe Journal of Chemical Physics, 1992
- Intermolecular interactions from a natural bond orbital, donor-acceptor viewpointChemical Reviews, 1988
- Why do molecules interact? The origin of electron donor-acceptor complexes, hydrogen bonding and proton affinityAccounts of Chemical Research, 1977
- A new energy decomposition scheme for molecular interactions within the Hartree‐Fock approximationInternational Journal of Quantum Chemistry, 1976