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Low-lying states of trinuclear mixed-valence cluster: [Fe3S4]0

✍ Scribed by M. V. Eremin; S. I. Nikitin; S. Yu. Prosvirnin


Publisher
Springer Vienna
Year
2002
Tongue
English
Weight
796 KB
Volume
23
Category
Article
ISSN
0937-9347

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The electronic structure of the ground state and electronic transition energies of low-lying states have been calculated using the INDO/S-CI method for MosX,(aq) :' cluster ions (X=0, S). It has been shown that the calculated values are in accordance with those observed experimentally, allowing us t