Exact transformations of CI spaces, VB representations of CASSCF wavefunctions and the optimization of VB wavefunctions-Reference-Cited by-同舟云学术

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Exact transformations of CI spaces, VB representations of CASSCF wavefunctions and the optimization of VB wavefunctions

Published:1996-10 Issue:4 Volume:94 Page:233-245
ISSN:0040-5744
Container-title:Theoretica Chimica Acta
language:en
Short-container-title:Theoret. Chim. Acta

Author:

Thorsteinsson Thorstein,Cooper David L.

Publisher

Springer Science and Business Media LLC

Subject

Chiropractics,Physical and Theoretical Chemistry

Link

http://link.springer.com/content/pdf/10.1007/BF00186445.pdf

Reference24 articles.

1. For a review of the CASSCF method see, for example: Roos BO (1987) Adv Chem Phys 69:399

2. For a review of the spin-coupled method see, for example: Cooper DL, Gerratt J, Raimondi M (1987) Adv Chem Phys 69:319

3. Thorsteinsson T (1995) Ph.D. Thesis, University of Liverpool, UK

4. Thorsteinsson T, Cooper DL, Gerratt J, Karadakov PB, Raimondi M (1996) Theor Chim Acta 93:343

5. Malmqvist PÅ (1986) Int J Quant Chem 30:479

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