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Spin states of (bio)inorganic systems: Successes and pitfalls |
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| Authors: | Marcel Swart |
| Institution: | 1. Institució Catalana de Recerca i Estudis Avan?ats (ICREA), Pg. Lluís Companys 23, 08010 Barcelona, Spain;2. Institut de Química Computacional and Departament de Química, Universitat de Girona, Campus Montilivi, 17071 Girona, Spain |
| Abstract: | |
| Keywords: | spin states transition metal complexes density functional theory wavefunction methods reactivity catalysis enzymes |