Periodic DFT Study of the Effects of Co‐Crystallization on a N‐Salicylideneaniline Molecular Switch

Research output: Contribution to specialist publicationArticle

Abstract

The front cover artwork is provided by the group of Benoît Champagne from the University of Namur. The image shows that in the solid state, a careful choice of the coformer can tune the relative stability of the keto-enol equilibrium. This was assessed using periodic DFT calculations. Read the full text of the Article at 10.1002/cphc.201900463.

Original languageEnglish
Pages2434-2442
Number of pages1
Volume20
No.19
Specialist publicationChemPhysChem
DOIs
Publication statusPublished - 2 Oct 2019

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