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QUASI: A general purpose implementation of the QM/MM approach and its application to problems in catalysis

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Thiel,  W.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

/persons/resource/persons59044

Thiel,  S.
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;
Research Department Thiel, Max-Planck-Institut für Kohlenforschung, Max Planck Society;

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Citation

Sherwood, P., de Vries, A. H., Guest, M. F., Schreckenbach, G., Catlow, C. R. A., French, S. A., et al. (2003). QUASI: A general purpose implementation of the QM/MM approach and its application to problems in catalysis. Journal of Molecular Structure-Theochem, 632(Sp. Iss. Sp. Iss. SI), 1-28. doi:10.1016/S0166-1280(03)00285-9.


Cite as: http://hdl.handle.net/11858/00-001M-0000-000F-9845-9
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