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(Q57905348)

English

Can DFT Accurately Predict Spin Densities? Analysis of Discrepancies in Iron Nitrosyl Complexes

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title
Can DFT Accurately Predict Spin Densities? Analysis of Discrepancies in Iron Nitrosyl Complexes (English)
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author
Katharina Boguslawski
object named as
Katharina Boguslawski
series ordinal
1
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Christoph R. Jacob
object named as
Christoph R. Jacob
series ordinal
2
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Markus Reiher
object named as
Markus Reiher
series ordinal
3
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publication date
13 September 2011
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volume
7
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issue
9
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page(s)
2740-2752
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Identifiers

DOI
10.1021/CT1006218
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