Polyoxovanadate clusters and cages: force-field parameterization

Menke C, Diemann E, Müller A (1997)
JOURNAL OF MOLECULAR STRUCTURE 437: 35-47.

Zeitschriftenaufsatz | Veröffentlicht | Englisch
 
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Abstract / Bemerkung
Polyoxovanadates currently present the most complex and most instructive series of structures of discrete inorganic host-guest species. A parameterization of the CERIUS force field derived from the structural data of examples of this type and of other polyoxovanadate clusters with a considerable variety of structures is reported. (C) 1997 Elsevier Science B.V.
Stichworte
supramolecular chemistry; molecular mechanics; force fields; host-guest compounds; polyoxometallates
Erscheinungsjahr
1997
Zeitschriftentitel
JOURNAL OF MOLECULAR STRUCTURE
Band
437
Seite(n)
35-47
ISSN
0022-2860
Page URI
https://pub.uni-bielefeld.de/record/1626539

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Menke C, Diemann E, Müller A. Polyoxovanadate clusters and cages: force-field parameterization. JOURNAL OF MOLECULAR STRUCTURE. 1997;437:35-47.
Menke, C., Diemann, E., & Müller, A. (1997). Polyoxovanadate clusters and cages: force-field parameterization. JOURNAL OF MOLECULAR STRUCTURE, 437, 35-47.
Menke, C, Diemann, Ekkehard, and Müller, Achim. 1997. “Polyoxovanadate clusters and cages: force-field parameterization”. JOURNAL OF MOLECULAR STRUCTURE 437: 35-47.
Menke, C., Diemann, E., and Müller, A. (1997). Polyoxovanadate clusters and cages: force-field parameterization. JOURNAL OF MOLECULAR STRUCTURE 437, 35-47.
Menke, C., Diemann, E., & Müller, A., 1997. Polyoxovanadate clusters and cages: force-field parameterization. JOURNAL OF MOLECULAR STRUCTURE, 437, p 35-47.
C. Menke, E. Diemann, and A. Müller, “Polyoxovanadate clusters and cages: force-field parameterization”, JOURNAL OF MOLECULAR STRUCTURE, vol. 437, 1997, pp. 35-47.
Menke, C., Diemann, E., Müller, A.: Polyoxovanadate clusters and cages: force-field parameterization. JOURNAL OF MOLECULAR STRUCTURE. 437, 35-47 (1997).
Menke, C, Diemann, Ekkehard, and Müller, Achim. “Polyoxovanadate clusters and cages: force-field parameterization”. JOURNAL OF MOLECULAR STRUCTURE 437 (1997): 35-47.
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