Quantum chemical calculations of spectroscopic properties of metalloproteins and model compounds: EPR and Mössbauer properties

Author:

Neese Frank

Publisher

Elsevier BV

Subject

Biochemistry,Analytical Chemistry

Reference77 articles.

1. Que L Jr (Ed): Physical Methods in Bioinorganic Chemistry. Sausalito, CA: University Science Books; 2000.

2. Solomon EIS, Lever ABP (Eds): Inorganic Electronic Structure and Spectroscopy. New York: John Wiley & Sons; 1999.

3. Transition-metal systems in biochemistry studied by high-accuracy quantum chemical methods;Siegbahn;Chem. Rev.,2000

4. Koch W, Holthausen MC: A Chemist’s Guide to Density Functional Theory. Weinheim, Germany: Wiley-VCH; 2000.

5. Neese F, Solomon EI: Interpretation and calculation of spin-Hamiltonian parameters in transition metal complexes. In Magnetoscience — From Molecules to Materials, vol 4. Edited by Drillon M, Miller JS. Wiley; 2002:in press.

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