Literature DB >> 19283291

The crystal structure of beta-RDX-an elusive form of an explosive revealed.

David I A Millar1, Iain D H Oswald, Duncan J Francis, William G Marshall, Colin R Pulham, Adam S Cumming.   

Abstract

The crystal structure of the highly metastable beta-form of RDX shows that the molecules adopt different conformations compared to the alpha-form and that, contrary to previous reports, the beta-form obtained at ambient pressure is not the same form as that obtained at elevated temperatures and pressures.

Entities:  

Year:  2008        PMID： 19283291     DOI： 10.1039/b817966b

Source DB:  PubMed          Journal:  Chem Commun (Camb)        ISSN： 1359-7345            Impact factor:   6.222


  5 in total

1.  Adsorption and decomposition mechanism of hexogen (RDX) on Al(111) surface by periodic DFT calculations.

Authors:  Cai-Chao Ye; Feng-Qi Zhao; Si-Yu Xu; Xue-Hai Ju
Journal:  J Mol Model       Date:  2013-02-24       Impact factor: 1.810

2.  Vibrational spectra of an RDX film over an aluminum substrate from molecular dynamics simulations and density functional theory.

Authors:  Julibeth M Martínez de la Hoz; Perla B Balbuena
Journal:  J Mol Model       Date:  2012-10-20       Impact factor: 1.810

3.  Crystal structure evolution of an energetic compound dihydroxylammonium 5,5'-bistetrazole-1,1'-diolate induced by solvents.

Authors:  Xin Xu; Dong Chen; Hongzhen Li; Mi Yan; Ying Xiong; Haixia Zhao; Rong Xu
Journal:  RSC Adv       Date:  2020-03-26       Impact factor: 4.036

4.  Carbon dioxide binary crystals via the thermal decomposition of RDX at high pressure.

Authors:  L E Connor; C A Morrison; I D H Oswald; C R Pulham; M R Warren
Journal:  Chem Sci       Date:  2017-05-04       Impact factor: 9.825

5.  Strategies for Achieving Balance between Detonation Performance and Crystal Stability of High-Energy-Density Materials.

Authors:  Chongyang Li; Hui Li; He-Hou Zong; Yongli Huang; Michael Gozin; Chang Q Sun; Lei Zhang
Journal:  iScience       Date:  2020-02-26
  5 in total

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