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"High-spin versus broken symmetry - Effect of DFT spin density ..."

R. C. Binning Jr., Daniel E. Bacelo (2008)

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DOI: 10.1002/JCC.20833

access: closed

type: Journal Article

metadata version: 2020-05-30

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R. C. Binning Jr., Daniel E. Bacelo:
High-spin versus broken symmetry - Effect of DFT spin density representation on the geometries of three diiron (III) model compounds. J. Comput. Chem. 29(5): 716-723 (2008)

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