Determination of the basis set superposition error with «DZP» basis sets in SCF calculations: CO+H2, NH3+H2, H2+H2

Journal article

Peer reviewed

L Kurdi, E Kochanski and G. H. F Diercksen

Chemical physics, Vol.92(2-3), pp.287-294

01/01/1985

Abstract

Atomic and molecular collision processes and interactions

Atomic and molecular physics

Exact sciences and technology

Interatomic and intermolecular potentials and forces, potential energy surfaces for collisions

Physics

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Title: Determination of the basis set superposition error with «DZP» basis sets in SCF calculations: CO+H2, NH3+H2, H2+H2
Creators - without role: L Kurdi - Univ. Louis Pasteur, E.R. No 139 C.N.R.S., Strasbourg, France
E Kochanski - Univ. Louis Pasteur, E.R. No 139 C.N.R.S., Strasbourg, France
G. H. F Diercksen - Max Planck Institute for Astrophysics
Publication Details: Chemical physics, Vol.92(2-3), pp.287-294
Publisher: Elsevier
Identifiers: 9936287808331
Academic Unit: King Abdulaziz University
Language: English
Resource Type: Journal article