Representing and understanding geometric features of one-dimensional tunnel structures in solid inclusion compounds
- 30 June 1995
- journal article
- Published by Elsevier BV in Journal of Molecular Graphics
- Vol. 13 (3), 138-141
- https://doi.org/10.1016/0263-7855(94)00016-l
Abstract
A computational method is presented for probing geometric, topological, and structural characteristics of one-dimensional tunnel structures in solid inclusion compounds. The method is illustrated for the urea and thiourea inclusion compounds, highlighting important structural differences between the urea and thiourea tunnel strctures, and potential areas of application of the methodology are discussed.Keywords
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