Can DFT Accurately Predict Spin Densities? Analysis of Discrepancies in Iron Nitrosyl Complexes
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Author / Producer
Date
2011-09
Publication Type
Journal Article
ETH Bibliography
yes
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Altmetric
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published
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Journal / series
Volume
7 (9)
Pages / Article No.
2740 - 2752
Publisher
American Chemical Society
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Edition / version
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Software
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Date created
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Organisational unit
03736 - Reiher, Markus / Reiher, Markus
Notes
Received 1 November 2010, Published online 15 August 2011.