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Electron localization function for transition-metal compounds

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Abstract.

 The analysis of the electron localization function of molecules and solids needs to involve the atomic core regions as well to reveal a more detailed insight into the bonding situation.

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Authors and Affiliations

  1. Max-Planck-Institut für Chemische Physik fester Stoffe, Nöthnitzer Strasse 40, 01187 Dresden, Germany, , , , , , DE

    Miroslav Kohout, Frank Richard Wagner & Yuri Grin

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  1. Miroslav Kohout
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  2. Frank Richard Wagner
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  3. Yuri Grin
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Received: 20 February 2002 /Accepted: 14 June 2002 /Published online: 19 August 2002

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Kohout, M., Wagner, F. & Grin, Y. Electron localization function for transition-metal compounds. Theor Chem Acc 108, 150–156 (2002). https://doi.org/10.1007/s00214-002-0370-x

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  • DOI: https://doi.org/10.1007/s00214-002-0370-x

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