Article ID Journal Published Year Pages File Type
5380580 Chemical Physics Letters 2014 5 Pages PDF
Abstract

- DFT studies were carried out for the novel derivatives of the azobenzene photoswitch.
- Possible design rules are given for future synthesis of photoswitches in the visible.
- Reactive MD simulations were performed to predict trans-to-cis ratio.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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