Header menu link for other important links
Isostructural polymorphs: Qualitative insights from energy frameworks
Jha K.K., Dutta S., Kumar V.,
Published in Royal Society of Chemistry
Volume: 18
Issue: 43
Pages: 8497 - 8505
Three isostructural polymorphs with two-dimensional and three-dimensional similarities are demonstrated quantitatively from similarity relationship analysis. The similarity dimensions are then visualized and correlated in a novel way via qualitative analysis using 'energy frameworks'. Two of the three polymorphs with three-dimensional similarities exhibiting identical physical properties have almost equi-energetic crystal structures while the most stable third polymorph exhibits distinct properties. Thereby, structure-property correlations are derived, both quantitatively and qualitatively. © 2016 The Royal Society of Chemistry.
About the journal
Published in Royal Society of Chemistry
Open Access
Impact factor