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Computational investigation on the reaction of dimethyl ether with nitric dioxide. II. Detailed chemical kinetic modeling

Theoretical chemistry accounts, 2020, Vol.139 (1), Article 1

2020

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Mechanism investigation on the reaction of methylmethoxy radical with nitrogen monoxide

Structural chemistry, 2021, Vol.32 (4), p.1563-1570

2021

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Theoretical mechanistic study on the reaction of the methoxymethyl radical with nitrogen dioxide

Journal of molecular modeling, 2021-01, Vol.27 (2), p.18-18, Article 18

2021

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Initial Thermal Decomposition Mechanism of (NH2)2CC(NO2)(ONO) Revealed by Double-Hybrid Density Functional Calculations

ACS omega, 2021-06, Vol.6 (23), p.15292-15299

2021

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Preparation, non-isothermal decomposition kinetics, heat capacity and adiabatic time-to-explosion of NTO·DNAZ

Journal of hazardous materials, 2009-09, Vol.169 (1), p.1068-1073

2009

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Preventive Conservation of Thangkas in the Buddha Hall of the West Warm Chamber of the Mental Cultivation Hall, Palace Museum, Beijing

Studies in conservation, 2018-08, Vol.63 (S1), p.454-456

2018

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Investigation on the Thermal Dissociation of Vinyl Nitrite with a Saddle Point Involved

ACS omega, 2019-10, Vol.4 (14), p.16052-16061

2019

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Synthesis, Crystal Structure and Non-covalent Interactions Analysis of Novel N-substituted Thiosemicarbazone

Chemical research in Chinese universities, 2019-06, Vol.35 (3), p.471-477

2019

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Thermal behavior, specific heat capacity and adiabatic time-to-explosion of G(FOX-7)

Journal of hazardous materials, 2008-10, Vol.158 (2), p.333-339

2008

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Three new compounds based on 4,4′-azo-1,2,4-triazol-5-one: Synthesis, crystal structure and thermal properties

Chemical research in Chinese universities, 2016-10, Vol.32 (5), p.812-817

2016

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Hetero-trinuclear near-infrared (NIR) luminescent Zn2Ln complexes from Salen-type Schiff-base ligands

New journal of chemistry, 2009, Vol.33 (11), p.2326

2009

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Syntheses and characterizations of two new energetic copper–amine-DNANT complexes and their effects on thermal decomposition of RDX

Journal of solid state chemistry, 2013-09, Vol.205, p.205-210

2013

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Reactive molecular dynamics simulation on thermal decomposition of n-heptane and methylcyclohexane initiated by nitroethane

Fuel (Guildford), 2020-02, Vol.261, p.116447, Article 116447

2020

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Synthesis, spectral characteristics, weak interactions, electronic properties and biological activity of (E)-1-(4-hydroxybenzylidene)-4-(3-isopropylphenyl)thiosemicarbazone: An experimental and theoretical approach

Journal of molecular structure, 2021-01, Vol.1224, p.129044, Article 129044

2021

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The ortho hydroxy-amino group: Another choice for synthesizing novel antioxidants

Bioorganic & medicinal chemistry letters, 2006-07, Vol.16 (13), p.3582-3585

2006

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Analysis of hydrogen bonding and weak interactions in the crystal structure of (E)-N-(4-ethylphenyl)-2-(4-hydroxybenzylidene)thiosemicarbazone: experimental and theoretical studies

Molecular physics, 2020-06, Vol.118 (12), p.e1670878

2020

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Syntheses and Thermal Behaviors of Rb(FOX-7)·H2O and Cs(FOX-7)·H2O

Bulletin of the Korean Chemical Society, 2010, 31(10), , pp.2867-2872

2010

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Non-isothermal Decomposition Kinetics of a New High-energy Organic Potassium Salt: K(DNDZ)

Bulletin of the Korean Chemical Society, 2009, 30(10), , pp.2259-2264

2009

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Exploring a possible way to synthesize novel better antioxidants based on vitamin E: A DFT study

Bioorganic & medicinal chemistry letters, 2006-11, Vol.16 (22), p.5874-5877

2006

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In-situ preparation of MgFe2O4-GO nanocomposite and its enhanced catalytic reactivity on decomposition of AP and RDX

Ceramics international, 2018-10, Vol.44 (15), p.19016-19020

2018

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Co-existence of heterometallic Zn2Er and ZnEr arrayed chromophores for the sensitization of near-infrared (NIR) luminescence

Inorganic chemistry communications, 2009-12, Vol.12 (12), p.1216-1219

2009

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Review on the Reactivity of 1,1-Diamino-2,2-dinitroethylene (FOX-7)

Propellants, explosives, pyrotechnics, 2016-02, Vol.41 (1), p.35-52

2016

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Kinetic modeling for unimolecular β-scission of the methoxymethyl radical from quantum chemical and RRKM analyses

Combustion and flame, 2018-11, Vol.197, p.243-253

2018

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Synthesis, structure, in silico ADME evaluation and in vitro antioxidant of (E)-N-(4-ethylphenyl)-2-(isomeric methylbenzylidene)thiosemicarbazone derivatives

Journal of molecular structure, 2020-01, Vol.1199, p.126972, Article 126972

2020

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Structural Characterization and Thermal Behavior of a Novel Energetic Material: 1-Amino-1-(2,4-dinitrophenylhydrazinyl)-2,2-dinitroethylene

Bulletin of the Korean Chemical Society, 2011, 32(7), , pp.2267-2273

2011

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Computational investigation on the reaction of dimethyl ether with nitric dioxide. II. Detailed chemical kinetic modeling

Mechanism investigation on the reaction of methylmethoxy radical with nitrogen monoxide

Theoretical mechanistic study on the reaction of the methoxymethyl radical with nitrogen dioxide

Initial Thermal Decomposition Mechanism of (NH2)2CC(NO2)(ONO) Revealed by Double-Hybrid Density Functional Calculations

Preparation, non-isothermal decomposition kinetics, heat capacity and adiabatic time-to-explosion of NTO·DNAZ

Preventive Conservation of Thangkas in the Buddha Hall of the West Warm Chamber of the Mental Cultivation Hall, Palace Museum, Beijing

Investigation on the Thermal Dissociation of Vinyl Nitrite with a Saddle Point Involved

Synthesis, Crystal Structure and Non-covalent Interactions Analysis of Novel N-substituted Thiosemicarbazone

Thermal behavior, specific heat capacity and adiabatic time-to-explosion of G(FOX-7)

Three new compounds based on 4,4′-azo-1,2,4-triazol-5-one: Synthesis, crystal structure and thermal properties

Hetero-trinuclear near-infrared (NIR) luminescent Zn2Ln complexes from Salen-type Schiff-base ligands

Syntheses and characterizations of two new energetic copper–amine-DNANT complexes and their effects on thermal decomposition of RDX

Reactive molecular dynamics simulation on thermal decomposition of n-heptane and methylcyclohexane initiated by nitroethane

Synthesis, spectral characteristics, weak interactions, electronic properties and biological activity of (E)-1-(4-hydroxybenzylidene)-4-(3-isopropylphenyl)thiosemicarbazone: An experimental and theoretical approach

The ortho hydroxy-amino group: Another choice for synthesizing novel antioxidants

Analysis of hydrogen bonding and weak interactions in the crystal structure of (E)-N-(4-ethylphenyl)-2-(4-hydroxybenzylidene)thiosemicarbazone: experimental and theoretical studies

Syntheses and Thermal Behaviors of Rb(FOX-7)·H2O and Cs(FOX-7)·H2O

Non-isothermal Decomposition Kinetics of a New High-energy Organic Potassium Salt: K(DNDZ)

Exploring a possible way to synthesize novel better antioxidants based on vitamin E: A DFT study

In-situ preparation of MgFe2O4-GO nanocomposite and its enhanced catalytic reactivity on decomposition of AP and RDX

Co-existence of heterometallic Zn2Er and ZnEr arrayed chromophores for the sensitization of near-infrared (NIR) luminescence

Review on the Reactivity of 1,1-Diamino-2,2-dinitroethylene (FOX-7)

Kinetic modeling for unimolecular β-scission of the methoxymethyl radical from quantum chemical and RRKM analyses

Synthesis, structure, in silico ADME evaluation and in vitro antioxidant of (E)-N-(4-ethylphenyl)-2-(isomeric methylbenzylidene)thiosemicarbazone derivatives

Structural Characterization and Thermal Behavior of a Novel Energetic Material: 1-Amino-1-(2,4-dinitrophenylhydrazinyl)-2,2-dinitroethylene

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