Search Results - "Racoveanu, Ana"

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  1. 1

    New thermal decomposition pathway for TATB by Morrison, Keith D., Racoveanu, Ana, Moore, Jason S., Burnham, Alan K., Koroglu, Batikan, Coffee, Keith R., Panasci-Nott, Adele F., Klunder, Gregory L., Steele, Bradley A., McClelland, M. A., Reynolds, John G.

    Published in Scientific reports (01-12-2023)
    “…Understanding the thermal decomposition behavior of TATB (1,3,5-triamino-2,4,6-trinitrobenzene) is a major focus in energetic materials research because of…”
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    Journal Article
  2. 2

    3-(4-Amino-1,2,5-oxadiazol-3-yl)-4-(4-nitro-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole by Pagoria, Philip, Zhang, Maoxi, Racoveanu, Ana, DeHope, Alan, Tsyshevsky, Roman, Kuklja, Maija

    Published in MolBank (22-05-2014)
    “…The title compound 3-(4-amino-1,2,5-oxadiazol-3-yl)-4-(4-nitro-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole (ANFF-1) was synthesized by: (1) by reaction of…”
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    Journal Article
  3. 3

    Searching for Low-Sensitivity Cast-Melt High-Energy-Density Materials: Synthesis, Characterization, and Decomposition Kinetics of 3,4-Bis(4-nitro-1,2,5-oxadiazol-3-yl)-1,2,5-oxadiazole-2-oxide by Tsyshevsky, Roman, Pagoria, Philip, Zhang, Maoxi, Racoveanu, Ana, DeHope, Alan, Parrish, Damon, Kuklja, Maija M

    Published in Journal of physical chemistry. C (19-02-2015)
    “…The most comprehensive approach to analyze and characterize energetic materials is suggested and applied to enable rational, rigorous design of novel materials…”
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    Journal Article
  4. 4

    Probing the Structural Effects of Hydrogen Bonding in 1,3,5-Triamino-2,4,6-trinitrobenzene (TATB): Experimental Evidence by 15N NMR Spectroscopy by Mason, Harris E., Colla, Christopher A., Racoveanu, Ana, Coffee, Keith R., Panasci-Nott, Adele F., Kahl, Evan M., Reynolds, John G.

    Published in Journal of physical chemistry. C (10-11-2022)
    “…Examining isotopically 15N-labeled versions of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) by NMR has experimentally demonstrated the effects of strong intra-…”
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    Journal Article
  5. 5

    Comprehensive End-to-End Design of Novel High Energy Density Materials: I. Synthesis and Characterization of Oxadiazole Based Heterocycles by Tsyshevsky, Roman, Pagoria, Philip, Zhang, Maoxi, Racoveanu, Ana, Parrish, Damon A, Smirnov, Aleksandr S, Kuklja, Maija M

    Published in Journal of physical chemistry. C (02-11-2017)
    “…A methodology to design novel energetic materials by means of a holistic approach that links synthesis, experimental characterization, quantum-chemical…”
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    Journal Article
  6. 6
  7. 7

    TATB thermal decomposition: An improved kinetic model for explosive safety analysis by Moore, Jason S., Morrison, Keith D., Burnham, Alan K., Racoveanu, Ana, Reynolds, John G., Koroglu, Batikan, Coffee, Keith R., Klunder, Greg L.

    Published in Propellants, explosives, pyrotechnics (20-12-2023)
    “…Abstract We investigate and model the cook‐off behavior of 1,3,5‐triamino‐2,4,6‐trinitrobenzene (TATB) to understand the response of explosive systems in…”
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    Journal Article
  8. 8

    Comparative analysis of sublimation and thermal decomposition of TATB by Koroglu, Batikan, Burnham, Alan K., Mashiana, Imren, Racoveanu, Ana, Arose, Christopher, Crowhurst, Jonathan C., Reynolds, John G.

    Published in Propellants, explosives, pyrotechnics (01-02-2024)
    “…This experimental study investigated the effects of confinement, starting mass, and heating rate on TATB thermal decomposition and sublimation using a combined…”
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    Journal Article
  9. 9
  10. 10

    TATB thermal decomposition: An improved kinetic model for explosive safety analysis by Moore, Jason S., Morrison, Keith D., Burnham, Alan K., Racoveanu, Ana, Reynolds, John G., Koroglu, Batikan, Coffee, Keith R., Klunder, Greg L.

    Published in Propellants, explosives, pyrotechnics (01-02-2024)
    “…We investigate and model the cook‐off behavior of 1,3,5‐triamino‐2,4,6‐trinitrobenzene (TATB) to understand the response of explosive systems in abnormal…”
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    Journal Article
  11. 11

    Syntheses and characterization of isotopically labeled 1,3,5‐triamino‐2,4,6‐trinitrobenzene (TATB) by Racoveanu, Ana, Coffee, Keith R., Panasci‐Nott, Adele F., Koroglu, Batikan, Colla, Christopher A., Lee, Jonathan R. I., Morrison, Keith D., Reynolds, John G.

    Published in Propellants, explosives, pyrotechnics (01-02-2024)
    “…Synthesis and characterization of chemical analogues of TATB, where specific atoms in the structure have been isotopically substituted, are reported. 15N, 2H,…”
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    Journal Article
  12. 12

    Experimental Investigation of the Thermal Decomposition Pathways and Kinetics of TATB by Isotopic Substitution by Koroglu, Batikan, Crowhurst, Jonathan C., Kahl, Evan M., Moore, Jason S., Racoveanu, Ana, Mason, Harris E., Weisz, David G., Reynolds, John G., Burnham, Alan K.

    Published in Propellants, explosives, pyrotechnics (01-09-2021)
    “…Real‐time measurements of the product gases arising from the thermal decomposition of triamino‐trinitro benzene (TATB), its deuterated analogue, and…”
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    Journal Article
  13. 13

    Vibrational Spectra of HNIW and its Isotopologues: A Combined Experimental and Computational Study by Burton, Mark A., Steele, Brad A., Crowhurst, Jonathan C., Racoveanu, Ana, Kuo, I‐Feng W., Shaw, William L., Gee, Richard H.

    Published in Propellants, explosives, pyrotechnics (01-03-2023)
    “…Incorporating isotopically labelled materials in degradation experiments could help unravel the mechanism(s) of decomposition through use of the kinetic…”
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    Journal Article
  14. 14

    Electronic and Molecular Structure of Aminimides (1-Acyl-2,2,2-trimethyldiazan-2-ium-1-ide). 1. Formaminimide (HCON-N+Me3) by Gheorghiu, Mircea D, Racoveanu, Ana, Zakin, Mitchell R

    “…The electronic structure and geometries of (Z)- and (E)-H-CON-N+(CH3)3 have been examined at two levels of theory:  B3LYP (basis sets 6-311+G(d,p),…”
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  15. 15

    Electronic and molecular structure of aminimides (1-acyl-2,2,2-trimethyl-diazan-2-ium-1-ide). 2. Substituted aminimides (R CON −N +Me 3) by Gheorghiu, Mircea D., Racoveanu, Ana

    Published in Journal of molecular structure. Theochem (30-08-2009)
    “…The electronic structure and geometries of substituted aminimides (R CON −N +(CH 3) 3) where R = H, F, OH, NH 2, N −N +(CH 3) 3, NO, NO 2, CN, CH 3, CF 3, CH…”
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    Journal Article
  16. 16