Theoretical Prediction of 2,4,6-Trinitro-1,3,5-triazine (TNTA). A New, Powerful, High-Energy Density Material?
- 1 January 1996
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of the American Chemical Society
- Vol. 118 (48) , 12244-12245
- https://doi.org/10.1021/ja962744b
Abstract
No abstract availableThis publication has 13 references indexed in Scilit:
- The 28-Electron Tetraatomic Molecules: N4, CN2O, BFN2, C2O2, B2F2, CBFO, C2FN, and BNO2. Challenges for Computational and Experimental ChemistryThe Journal of Physical Chemistry, 1996
- Theoretical determination of structural parameters for s-triazine and some derivatives. Comparison between ab initio and semi-empirical calculationsChemical Physics Letters, 1993
- Potential energy surface of borazirene (HCNBH)The Journal of Physical Chemistry, 1992
- C2H4B2N2: a prediction of ring and chain [boron-nitrogen-carbon] compoundsJournal of the American Chemical Society, 1992
- Hydrogen pentazole: does it exist?Journal of the American Chemical Society, 1992
- Interconversion of diborane (4) isomersThe Journal of Chemical Physics, 1992
- Do stable isomers of N3H3 exist?Journal of the American Chemical Society, 1988
- The stabilization energy of 1,3,5-triazine derived from measurements of the enthalpies of combustion and sublimationThe Journal of Chemical Thermodynamics, 1982
- Prediction of density in organic crystalsActa Crystallographica Section A, 1977
- The crystal structure of 1,3,5-trinitrobenzene by neutron diffractionActa Crystallographica Section B: Structural Science, Crystal Engineering and Materials, 1972