Data di Pubblicazione:
2014
Citazione:
Applied Topological Analysis of Crystal Structures with the Program Package ToposPro / V.A. Blatov, A.P. Shevchenko, D.M. Proserpio. - In: CRYSTAL GROWTH & DESIGN. - ISSN 1528-7483. - 14:7(2014), pp. 3576-3586. [10.1021/cg500498k]
Abstract:
Basic concepts of computer topological analysis of crystal
structures realized in the current version of the program package ToposPro
are considered. Applications of the ToposPro methods to various classes of
chemical compoundscoordination polymers, molecular crystals, supramolecular
ensembles, inorganic ionic compounds, intermetallics, fast-ion
conductors, microporous materialsare illustrated by many examples. It is
shown that chemically and crystallographically different structures can be
automatically treated in a similar way with the ToposPro approaches.
Tipologia IRIS:
01 - Articolo su periodico
Elenco autori:
V.A. Blatov, A.P. Shevchenko, D.M. Proserpio
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