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Chapter title |
Comparison of pure and hybrid DFT functionals for geometry optimization and calculation of redox potentials for iron nitrosyl complexes with “μ-SCN” bridging ligands
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Chapter number | 12 |
Book title |
8th Congress on Electronic Structure: Principles and Applications (ESPA 2012)
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Published by |
Springer, Berlin, Heidelberg, January 2014
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DOI | 10.1007/978-3-642-41272-1_12 |
Book ISBNs |
978-3-64-241271-4, 978-3-64-241272-1
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Authors |
Nina Emel’yanova, Nataliya Sanina, Alexander Krivenko, Roman Manzhos, Konstantin Bozhenko, Sergey Aldoshin |