An SCC-DFTB Repulsive Potential for Various ZnO Polymorphs and the ZnO-Water System

Matti Hellström1, Kjell Jorner, Maria Bryngelsson

  • 1Department of Chemistry, The Ångström Laboratory, Uppsala University , Box 538, SE-751 21 Uppsala, Sweden.

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Intermolecular Forces

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Intermolecular Forces

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Crystal Field Theory
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CFT focuses on...
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