Interpretation and calculation of the parameters of the model of angular overlap of orbitals based on the local method of effective crystal fieldстатья
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Дата последнего поиска статьи во внешних источниках: 18 июля 2013 г.
Местоположение издательства:Road Town, United Kingdom
Первая страница:296
Последняя страница:303
Аннотация:The effective crystal field method, which allows crystal field parameters to be estimated semiempirically, can be reformulated for calculating angular overlap model parameters solely from the geometry of transition metal complexes with the use of the initial effective crystal field model parameters. The suggested procedure fairly well reproduces the angular overlap model parameters for ligands in transition metal complexes that were determined by analyzing experimental data.