A quantitative quantum-chemical analysis tool for the distribution of mechanical force in molecules
The promising field of mechanochemistry suffers from a general lack of understanding of the distribution and propagation of force in a stretched molecule, which limits its applicability up to the present day. In this article, we introduce the JEDI (Judgement of Energy DIstribution) analysis, which i...
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| Main Authors: | , |
|---|---|
| Format: | Article (Journal) |
| Language: | English |
| Published: |
4 April 2014
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| In: |
The journal of chemical physics
Year: 2014, Volume: 140, Issue: 13 |
| ISSN: | 1089-7690 |
| DOI: | 10.1063/1.4870334 |
| Online Access: | Verlag, Volltext: http://dx.doi.org/10.1063/1.4870334
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| Author Notes: | Tim Stauch and Andreas Dreuwa |
MARC
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