Abstract:Recebido em 0708/2019; aceito em 30/10/2019; publicado na web em 19/12/2019 USE OF THE DENSITY FUNCTIONAL THEORY IN SPIN CROSSOVER ANALYSIS IN INORGANIC CHEMISTRY CLASSES. Spin crossover is a property found in some coordination compounds formed by the first series of transition metals with d 4-d 7 configuration. These complexes, when stimulated by an external factor (temperature, light, etc.), can be converted from their low spin states to high spin states, or vice versa. However, this issue is not addressed i… Show more
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