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Understanding Covalent Mechanochemistry |
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| Authors: | Jordi Ribas‐Arino Dr. Motoyuki Shiga Dr. Dominik Marx Prof. Dr. |
| Affiliation: | 1. Lehrstuhl für Theoretische Chemie, Ruhr‐Universit?t Bochum, 44780 Bochum (Germany);2. Permanent address: Center for Computational Science and E‐Systems, Japan Atomic Energy Agency (JAEA), Higashi‐Ueno 6‐9‐3, Taito‐ku, Tokyo 110‐0015 (Japan) |
| Abstract: | The time is ripe : A general theoretical framework based on force‐transformed potential energy surfaces rationalizes the intriguing results of recent experiments in the emerging field of covalent mechanochemistry.  |
| Keywords: | computer chemistry electrocyclic reactions mechanochemistry |