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3,149
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A complete active space SCF method (CASSCF) using a density matrix formulated super-CI approach
Author(s):
Björn O. Roos
,
Peter R. Taylor
,
Per E.M. Si≐gbahn
Publication date
Created:
May 1980
Publication date
(Print):
May 1980
Journal:
Chemical Physics
Publisher:
Elsevier BV
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Roothaan-Hartree-Fock atomic wavefunctions
Enrico Clementi
,
Carla Roetti
(1974)
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New Developments in Molecular Orbital Theory
C. C. J. Roothaan
(1951)
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Quantum Theory of Many-Particle Systems. I. Physical Interpretations by Means of Density Matrices, Natural Spin-Orbitals, and Convergence Problems in the Method of Configurational Interaction
Per-Olov Löwdin
(1955)
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Author and article information
Journal
Title:
Chemical Physics
Abbreviated Title:
Chemical Physics
Publisher:
Elsevier BV
ISSN (Print):
03010104
Publication date Created:
May 1980
Publication date (Print):
May 1980
Volume
: 48
Issue
: 2
Pages
: 157-173
Article
DOI:
10.1016/0301-0104(80)80045-0
SO-VID:
d2096559-3520-4dbb-85d4-be405e054181
Copyright ©
© 1980
License:
http://www.elsevier.com/tdm/userlicense/1.0/
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