Ligand field splitting for a diffuse charge model |
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Authors: | V Bonačić M Randić |
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Institution: | 1. Institute ?Rudjer Bo?kovi?“, Zagreb, Yugoslavia
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Abstract: | The simple electrostatic point charge model of the ligand field theory is extended by representing each ligand by N fractional point charges. The special cases N=6,18, and 62 are considered. A spherical charge distribution gives results similar to those of the point charge model. The splittings for non-spherical charge distributions are found to depend strongly on the orientation of the ligand charge. |
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