Intermolecular Forces and Molecular Dynamics Simulation of 1,3,5-Triamino-2,4,6-trinitrobenzene (TATB) Using Symmetry Adapted Perturbation Theory
Author:
Affiliation:
1. U.S. Army Research Laboratory, Aberdeen Proving Ground, Maryland 21005, United States
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp4005289
Reference46 articles.
1. The crystal structure of 1,3,5-triamino-2,4,6-trinitrobenzene
2. Second-harmonic generation and the shock sensitivity of TATB
3. Balancing steric and electronic factors in push-pull benzenes: an ab initio study on the molecular structure of 1,3,5-triamino-2,4,6-trinitrobenzene and related compounds
4. “Stubborn” triaminotrinitrobenzene: Unusually high chemical stability of a molecular solid to 150 GPa
5. Growth of 1,3,5-Triamino-2,4,6-trinitrobenzene (TATB) I. Anisotropic thermal expansion
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