"Combining ab initio techniques with analytical potential functions for ..."

Uwe Eichler, Christoph M. Kölmel, Joachim Sauer (1997)

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DOI: 10.1002/(SICI)1096-987X(199703)18:4<463::AID-JCC2>3.0.CO;2-R

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type: Journal Article

metadata version: 2020-04-01

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Uwe Eichler, Christoph M. Kölmel, Joachim Sauer:
Combining ab initio techniques with analytical potential functions for structure predictions of large systems: Method and application to crystalline silica polymorphs. J. Comput. Chem. 18(4): 463-477 (1997)

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