Search Results - "Tewari, Surya P."
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Isoconversional Kinetic Analysis of Decomposition of Nitroimidazoles: Friedman method vs Flynn–Wall–Ozawa Method
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (10-10-2013)“…We have investigated the decomposition kinetics of imidazole, 2-nitroimidazole, and 4-nitroimidazole using TG-DTA technique under nitrogen atmosphere…”
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2
Femtosecond Ablation of Silicon in Acetone: Tunable Photoluminescence from Generated Nanoparticles and Fabrication of Surface Nanostructures
Published in Journal of physical chemistry. C (03-04-2014)“…Silicon (Si) nanoparticles (NPs) and self-organized high spatial frequency laser (HSFL) induced periodic surface structures were fabricated by means of…”
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3
Structural, electronic, bonding, and elastic properties of NH3BH3: A density functional study
Published in Journal of computational chemistry (01-06-2011)“…The structural, electronic, bonding, and elastic properties of the low‐temperature orthorhombic phase of NH3BH3 are studied by means of first‐principles total…”
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4
Isoconversional kinetic analysis of decomposition of nitropyrazoles
Published in Thermochimica acta (20-12-2012)“…► Azoles undergo peculiar decomposition mechanism. ► Pyrazole and C-nitropyrazoles decomposed by multi step kinetics. ► N-nitropyrazole decomposed by single or…”
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Incorporation of Support Vector Machines in the LIBS Toolbox for Sensitive and Robust Classification Amidst Unexpected Sample and System Variability
Published in Analytical chemistry (Washington) (20-03-2012)“…Despite the intrinsic elemental analysis capability and lack of sample preparation requirements, laser-induced breakdown spectroscopy (LIBS) has not been…”
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Synthesis of Amino, Azido, Nitro, and Nitrogen-Rich Azole-Substituted Derivatives of 1H-Benzotriazole for High-Energy Materials Applications
Published in Chemistry : a European journal (19-11-2012)“…The amino, azido, nitro, and nitrogen‐rich azole substituted derivatives of 1H‐benzotriazole have been synthesized for energetic material applications. The…”
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Laser-induced breakdown spectroscopy-based investigation and classification of pharmaceutical tablets using multivariate chemometric analysis
Published in Talanta (Oxford) (15-12-2011)“…► LIBS and chemometrics used for classification of pharmaceutical tablets. ► PCA and SIMCA were used for classification and prediction. ► First three principle…”
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Shockwave and cavitation bubble dynamics of atmospheric air
Published in EPJ Web of conferences (01-01-2013)“…The generation and evolution of laser induced shock waves (SWs) and the hot core plasma (HCP) created by focusing 7 ns, 532 nm laser pulses in ambient air is…”
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Two-photon and three-photon absorption in dinaphthoporphycenes
Published in Chemical physics letters (27-09-2011)“…[Display omitted] ► Five different porphycenes were studied using Z-scan technique and 2ps pulses. ► Large values of n2 recorded for all the molecules. ►…”
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Ultrafast Excited-State Dynamics and Dispersion Studies of Third-Order Optical Nonlinearities in Novel Corroles
Published in Journal of physical chemistry. C (23-08-2012)“…Ultrafast nonlinear optical (NLO) properties of four novel Corroles in the visible spectral range (660–800 nm) were evaluated using picosecond Z-scan…”
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Structural, thermodynamic and optical properties of MgF2 studied from first-principles theory
Published in Journal of solid state chemistry (01-02-2011)Get full text
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12
Molecular formation dynamics of 5-nitro-2,4-dihydro-3H-1,2,4-triazol-3-one, 1,3,5-trinitroperhydro-1,3,5-triazine, and 2,4,6-trinitrotoluene in air, nitrogen, and argon atmospheres studied using femtosecond laser induced breakdown spectroscopy
Published in Spectrochimica acta. Part B: Atomic spectroscopy (01-09-2013)“…Femtosecond laser induced breakdown spectroscopic (LIBS) studies were performed on three high energy materials namely…”
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13
First principles calculations of LiNH2 BH3, LiNH3 BH4, and NaNH2 BH3
Published in physica status solidi (b) (01-04-2014)“…The structural, bonding and elastic properties of alkali amidoboranes (LiNH2 BH3, LiNH3 BH4, and NaNH2 BH3) have been studied. We employ first principles…”
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14
Growth of superhydrophobic Zinc oxide nanowire thin films
Published in Materials letters (15-05-2012)“…The growth of ZnO nanowire films by the annealing of Zn films deposited onto borosilicate glass and quartz substrates, at 500°C, is demonstrated. The as…”
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15
Thermal decomposition kinetics of 1-methyl-3,4,5-trinitropyrazole
Published in Thermochimica acta (2012)“…► 1-Methyl-3,4,5-trinitropyrazole (MTNP), a next generation melt cast explosive was synthesized in two step reaction. ► The compound showed good thermal…”
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16
Theoretical studies on nitrogen rich energetic azoles
Published in Journal of molecular modeling (01-06-2011)“…Different nitro azole isomers based on five membered heterocyclics were designed and investigated using computational techniques in order to find out the…”
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17
Dynamical and statistical behavior of discrete combustion waves: a theoretical and numerical study
Published in Physical review. E, Statistical, nonlinear, and soft matter physics (01-04-2013)“…We present a detailed theoretical and numerical study of combustion waves in a discrete one-dimensional disordered system. The distances between neighboring…”
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18
Picosecond nonlinear optical studies of unsymmetrical alkyl and alkoxy phthalocyanines
Published in Materials letters (15-09-2010)“…We present our results on picosecond nonlinearities in unsymmetrical alkyl and alkoxy phthalocyanines, studied using the Z-scan technique. Both open and closed…”
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Theoretical studies on the structure and detonation properties of amino-, methyl-, and nitro-substituted 3,4,5-trinitro-1H-pyrazoles
Published in Journal of hazardous materials (15-11-2010)“…In this study, 3,4,5-trinitro-1H-pyrazole (R20), 3,4,5-trinitro-1H-pyrazol-1-amine (R21), 1-methyl-3,4,5-trinitro-1H-pyrazole (R22), and…”
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A DFT Study on the Structures and Energies of Isomers of 4-Amino-1,3-dinitro-1,2,4-triazol-5-one-2-oxide: New High Energy Density Compounds
Published in Propellants, explosives, pyrotechnics (01-06-2013)“…Isomers of 4‐amino‐1,3‐dinitrotriazol‐5‐one‐2‐oxide (ADNTONO) are of interest in the contest of insensitive explosives and were found to have true local energy…”
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