The Journal of Chemical Physics

Paper

22 Aug 2003

On the SCF-LCAO-MO and the SCF-Xa-SW approximations: Computation of the barrier to internal rotation for ethane

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Paper

Study of the electronic structure of molecules. XVIII. Interaction between a lithium atom and a cyano group as an example of a polytopic bond

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Study of the electronic structure of molecules. Barriers to internal rotation in polynucleotide chains

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Study of the structure of molecular complexes. VIII. Small clusters of water molecules surrounding Li⁺, Na⁺, K⁺, F^-, and Cl^- ions

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SCF-LCAO-MO wave functions for the bifluoride ion

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