Ab initio geometry optimisation of the C1S(H)OHCl uneven sulfurane with the inclusion of electron correlation-Reference-Cited by-同舟云学术

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Ab initio geometry optimisation of the C1S(H)OHCl uneven sulfurane with the inclusion of electron correlation

Published:1994-12 Issue: Volume:315 Page:29-33
ISSN:0166-1280
Container-title:Journal of Molecular Structure: THEOCHEM
language:en
Short-container-title:Journal of Molecular Structure: THEOCHEM

Author:

Csonkaa Gábor I.,Loos Michel,Kucsman Árpád,Csizmadiad Imre G.

Publisher

Elsevier BV

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Biochemistry

Reference22 articles.

1. Conformationally induced double degenerate uneven sulfuranes

2. Constitutionally Symmetric, Structurally Uneven Sulfuranes. A Theoretical Study

3. E.A. Innes, I.G. Csizmadia, J.-L. Rivail, M. Loos and Á. Kucsman, Can. J. Chem., in press.

4. Compact effective potentials and efficient shared‐exponent basis sets for the first‐ and second‐row atoms

5. Self-consistent molecular orbital methods. 21. Small split-valence basis sets for first-row elements

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1. Finding pathways between distant local minima;The Journal of Chemical Physics;2005-06-15

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