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Journal Abstract Search


478 related items for PubMed ID: 19143546

  • 1. Experimental and theoretical exploration of the initial steps in the decomposition of a model nitramine energetic material: dimethylnitramine.
    Bhattacharya A, Guo YQ, Bernstein ER.
    J Phys Chem A; 2009 Feb 05; 113(5):811-23. PubMed ID: 19143546
    [Abstract] [Full Text] [Related]

  • 2. A comparison of the decomposition of electronically excited nitro-containing molecules with energetic moieties C-NO2, N-NO2, and O-NO2.
    Bhattacharya A, Guo Y, Bernstein ER.
    J Chem Phys; 2012 Jan 14; 136(2):024321. PubMed ID: 22260593
    [Abstract] [Full Text] [Related]

  • 3. Nonadiabatic decomposition of gas-phase RDX through conical intersections: an ONIOM-CASSCF study.
    Bhattacharya A, Bernstein ER.
    J Phys Chem A; 2011 May 05; 115(17):4135-47. PubMed ID: 21480653
    [Abstract] [Full Text] [Related]

  • 4. Ultrafast S1 to S0 internal conversion dynamics for dimethylnitramine through a conical intersection.
    Guo Y, Bhattacharya A, Bernstein ER.
    J Phys Chem A; 2011 Sep 01; 115(34):9349-53. PubMed ID: 21351779
    [Abstract] [Full Text] [Related]

  • 5. On the excited electronic state dissociation of nitramine energetic materials and model systems.
    Guo YQ, Greenfield M, Bhattacharya A, Bernstein ER.
    J Chem Phys; 2007 Oct 21; 127(15):154301. PubMed ID: 17949143
    [Abstract] [Full Text] [Related]

  • 6. Excited electronic state decomposition of furazan based energetic materials: 3,3'-diamino-4,4'-azoxyfurazan and its model systems, diaminofurazan and furazan.
    Guo YQ, Bhattacharya A, Bernstein ER.
    J Chem Phys; 2008 Jan 21; 128(3):034303. PubMed ID: 18205494
    [Abstract] [Full Text] [Related]

  • 7. Experimental and theoretical studies of the decomposition of new imidazole based energetic materials: model systems.
    Yu Z, Bernstein ER.
    J Chem Phys; 2012 Sep 21; 137(11):114303. PubMed ID: 22998258
    [Abstract] [Full Text] [Related]

  • 8. Decomposition of pentaerythritol tetranitrate [C(CH2ONO2)4] following electronic excitation.
    Yu Z, Bernstein ER.
    J Chem Phys; 2011 Oct 21; 135(15):154305. PubMed ID: 22029311
    [Abstract] [Full Text] [Related]

  • 9. Nonadiabatic reaction of energetic molecules.
    Bhattacharya A, Guo Y, Bernstein ER.
    Acc Chem Res; 2010 Dec 21; 43(12):1476-85. PubMed ID: 20931955
    [Abstract] [Full Text] [Related]

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  • 11. On the decomposition mechanisms of new imidazole-based energetic materials.
    Yu Z, Bernstein ER.
    J Phys Chem A; 2013 Feb 28; 117(8):1756-64. PubMed ID: 23388058
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  • 14. Theoretical predictions of the initial decomposition steps of dimethylnitramine.
    Velardez GF, Alavi S, Thompson DL.
    J Chem Phys; 2005 Aug 15; 123(7):074313. PubMed ID: 16229576
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  • 16. Decomposition of nitramine energetic materials in excited electronic states: RDX and HMX.
    Guo YQ, Greenfield M, Bernstein ER.
    J Chem Phys; 2005 Jun 22; 122(24):244310. PubMed ID: 16035760
    [Abstract] [Full Text] [Related]

  • 17. Ab initio multiple spawning dynamics study of dimethylnitramine and dimethylnitramine-Fe complex to model their ultrafast nonadiabatic chemistry.
    Bera A, Ghosh J, Bhattacharya A.
    J Chem Phys; 2017 Jul 28; 147(4):044308. PubMed ID: 28764390
    [Abstract] [Full Text] [Related]

  • 18. An ab initio/RRKM study of product branching ratios in the photodissociation of buta-1,2- and -1,3-dienes and but-2-yne at 193 nm.
    Lee HY, Kislov VV, Lin SH, Mebel AM, Neumark DM.
    Chemistry; 2003 Feb 03; 9(3):726-40. PubMed ID: 12569465
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  • 20. Initial mechanisms for the decomposition of electronically excited energetic salts: TKX-50 and MAD-X1.
    Yuan B, Yu Z, Bernstein ER.
    J Phys Chem A; 2015 Mar 26; 119(12):2965-81. PubMed ID: 25741885
    [Abstract] [Full Text] [Related]


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