SINDO1 II. Application to ground states of molecules containing carbon,nitrogen and oxygen atoms |
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Authors: | Karl Jug D N Nanda |
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Institution: | (1) Theoretische Chemie, Universität Hannover, Callinstr. 3A, 3000 Hannover, Federal Republic of Germany |
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Abstract: | Molecular geometries, binding energies, ionization potentials and dipole moments are calculated by the SINDO1 method for a large number of molecules containing C, N and O atoms. Comparison is made with MINDO/3, MNDO and where possible with STO-3G results. The explicit data and an error statistics show the relative merits of SINDO1. |
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Keywords: | Application of SINDO1 to ground states of molecules Containing C N O |
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