Expanded orbitals in SCF-LCAO-MO computations and reliability of virtual orbitals

By Zeeck E.  

Molecular Physics, Vol. 18, Iss. 2, 1970-02 ,pp. : 285-287

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An ab initio SCF-LCAO-MO study of the phosphorus pyramidal inversion process in phosphine

By Lehn J.M.   Munsch B.  

Molecular Physics, Vol. 23, Iss. 1, 1972-01 ,pp. : 91-107

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Ab initio SCF-LCAO-MO study of conformational stability and internal rotation in n-butane, ethyl methyl ether and ethyl methyl sulphide

By Brédas J.L.   Dufey M.   Fripiat J.G.   Andre J.M.  

Molecular Physics, Vol. 49, Iss. 6, 1983-08 ,pp. : 1451-1460

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Model pseudopotential open-shell LCAO-MO-SCF calculations on alkali metal trimers

By Hart George   Goodfriend P. L.  

Molecular Physics, Vol. 29, Iss. 4, 1975-04 ,pp. : 1109-1116

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An ab initio LCAO-MO-SCF study of reaction paths for proton transfer in ammonium aqueous solution

By Delpuech Jean-Jacques   Serratrice Guy   Strich Alain   Veillard Alain  

Molecular Physics, Vol. 29, Iss. 3, 1975-03 ,pp. : 849-871

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