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Search for the Decomposition Process of 2,4,6-Trinitrotoluene by an Evolutionary Algorithm
- Source :
- The Journal of Physical Chemistry A. 126:8082-8087
- Publication Year :
- 2022
- Publisher :
- American Chemical Society (ACS), 2022.
-
Abstract
- In this paper, we explored stable states in the system of 2,4,6-trinitrotoluene (TNT) crystal with a few additional hydrogen radicals (H
- Subjects :
- Physical and Theoretical Chemistry
Subjects
Details
- ISSN :
- 15205215 and 10895639
- Volume :
- 126
- Database :
- OpenAIRE
- Journal :
- The Journal of Physical Chemistry A
- Accession number :
- edsair.doi.dedup.....31423b5bf6066930eee7e1bc34fb5656
- Full Text :
- https://doi.org/10.1021/acs.jpca.2c04913