Local and density fitting approximations within the short-range/long-range hybrid scheme : application to large non-bonded complexes Explicit-r12 correlation methods and local correlation methods

Saved in:
Bibliographic Details
Published inPhysical chemistry chemical physics : PCCP Vol. 10; no. 23; pp. 3353 - 3357
Main Authors GOLL, Erich, LEININGER, Thierry, MANBY, Frederick R, MITRUSHCHENKOV, Alexander, WERNER, Hans-Joachim, STOLL, Hermann
Format Journal Article
LanguageEnglish
Published Cambridge Royal Society of Chemistry 2008
Subjects
Atomic and molecular physics
Chemistry
Electron correlation calculations for atoms and molecules
Electronic structure of atoms, molecules and their ions: theory
Exact sciences and technology
General and physical chemistry
Physics
Density functional
Binding energy
Molecular cluster
Wave function
Database
Theoretical study
Ab initio calculations
Electron correlation
Complexes
Density
Online AccessGet full text

Cover

More Information
ISSN:1463-9076
1463-9084