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Energy localization efficiency in 1,3,5-trinitro-2,4,6-triaminobenzene pore collapse mechanisms

Journal of applied physics, 2023-01, Vol.133 (3)

2023

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High-pressure and temperature neural network reactive force field for energetic materials

The Journal of chemical physics, 2023-04, Vol.158 (14), p.144117-144117

2023

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Hotspot formation due to shock-induced pore collapse in 1,3,5,7-tetranitro-1,3,5,7-tetrazoctane (HMX): Role of pore shape and shock strength in collapse mechanism and temperature

Journal of applied physics, 2020-05, Vol.127 (17)

2020

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High pressure suppression of plasticity due to an overabundance of shear embryo formation

npj computational materials, 2024-07, Vol.10 (1), p.147-6, Article 147

2024

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Chemistry Under Shock Conditions

Annual review of materials research, 2021-07, Vol.51 (1), p.101-130

2021

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The Potential Energy Hotspot: Effects of Impact Velocity, Defect Geometry, and Crystallographic Orientation

Journal of physical chemistry. C, 2022-02, Vol.126 (7), p.3743-3755

2022

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A Hotspot’s Better Half: Non-Equilibrium Intra-Molecular Strain in Shock Physics

The journal of physical chemistry letters, 2021-03, Vol.12 (11), p.2756-2762

2021

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Fourier-like Thermal Relaxation of Nanoscale Explosive Hot Spots

Journal of physical chemistry. C, 2021-09, Vol.125 (37), p.20570-20582

2021

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Continuum and molecular dynamics simulations of pore collapse in shocked β-tetramethylene tetranitramine (β-HMX) single crystals

Journal of applied physics, 2021-01, Vol.129 (1)

2021

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Extemporaneous Mechanochemistry: Shock-Wave-Induced Ultrafast Chemical Reactions Due to Intramolecular Strain Energy

The journal of physical chemistry letters, 2022-07, Vol.13 (29), p.6657-6663

2022

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Sensitivity of the Shock Initiation Threshold of 1,3,5-Triamino-2,4,6-trinitrobenzene (TATB) to Nuclear Quantum Effects

Journal of physical chemistry. C, 2019-09, Vol.123 (36), p.21969-21981

2019

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Influence of Pore Surface Structure and Contents on Shock-Induced Collapse and Energy Localization

Journal of physical chemistry. C, 2023-05, Vol.127 (20), p.9887-9895

2023

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Deviatoric stress driven transient melting below the glass transition temperature in shocked polymers

Journal of applied physics, 2022-07, Vol.132 (3)

2022

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Interplay of Mechanochemistry and Material Processes in the Graphite to Diamond Phase Transformation

The journal of physical chemistry letters, 2023-09, Vol.14 (38), p.8584-8589

2023

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Unsupervised Learning-Based Multiscale Model of Thermochemistry in 1,3,5-Trinitro-1,3,5-triazinane (RDX)

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2020-11, Vol.124 (44), p.9141-9155

2020

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Systematic Builder for All‐Atom Simulations of Plastically Bonded Explosives

Propellants, explosives, pyrotechnics, 2022-08, Vol.47 (8), p.n/a

2022

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Predicted Reaction Mechanisms, Product Speciation, Kinetics, and Detonation Properties of the Insensitive Explosive 2,6-Diamino-3,5-dinitropyrazine-1-oxide (LLM-105)

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-03, Vol.125 (8), p.1766-1777

2021

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Erratum: Continuum and molecular dynamics simulations of pore collapse in shocked β-tetramethylene tetranitramine (β-HMX) single crystals. [J. Appl. Phys. 129, 015904 (2021)]

Journal of applied physics, 2021-09, Vol.130 (10)

2021

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Intergranular Hotspots: A Molecular Dynamics Study on the Influence of Compressive and Shear Work

Journal of physical chemistry. C, 2023-05, Vol.127 (20), p.9858-9870

2023

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Hotspot formation due to shock-induced pore collapse in 1,3,5,7-tetranitro-1,3,5,7-tetrazoctane (HMX): Role of pore shape and shock strength in collapse mechanism and temperature

Journal of applied physics, 2020-05, Vol.127 (17)

2020

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Many-body mechanochemistry: Intramolecular strain in condensed matter chemistry

Physical review materials, 2023-07, Vol.7 (7), Article 075601

2023

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The Potential Energy Hotspot: Effects of Impact Velocity, Defect Geometry, and Crystallographic Orientation

Journal of physical chemistry. C, 2022-02, Vol.126 (7)

2022

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Intergranular Hotspots: A Molecular Dynamics Study on the Influence of Compressive and Shear Work

Journal of physical chemistry. C, 2023-05, Vol.127 (20)

2023

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A Hotspot’s Better Half: Non-Equilibrium Intra-Molecular Strain in Shock Physics

The journal of physical chemistry letters, 2021-03, Vol.12 (11)

2021

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Rapid activation of non-oriented mechanophores via shock loading and spallation

Physical review materials, 2023-04, Vol.7 (4), Article 045601

2023

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Energy localization efficiency in 1,3,5-trinitro-2,4,6-triaminobenzene pore collapse mechanisms

High-pressure and temperature neural network reactive force field for energetic materials

Hotspot formation due to shock-induced pore collapse in 1,3,5,7-tetranitro-1,3,5,7-tetrazoctane (HMX): Role of pore shape and shock strength in collapse mechanism and temperature

High pressure suppression of plasticity due to an overabundance of shear embryo formation

Chemistry Under Shock Conditions

The Potential Energy Hotspot: Effects of Impact Velocity, Defect Geometry, and Crystallographic Orientation

A Hotspot’s Better Half: Non-Equilibrium Intra-Molecular Strain in Shock Physics

Fourier-like Thermal Relaxation of Nanoscale Explosive Hot Spots

Continuum and molecular dynamics simulations of pore collapse in shocked β-tetramethylene tetranitramine (β-HMX) single crystals

Extemporaneous Mechanochemistry: Shock-Wave-Induced Ultrafast Chemical Reactions Due to Intramolecular Strain Energy

Sensitivity of the Shock Initiation Threshold of 1,3,5-Triamino-2,4,6-trinitrobenzene (TATB) to Nuclear Quantum Effects

Influence of Pore Surface Structure and Contents on Shock-Induced Collapse and Energy Localization

Deviatoric stress driven transient melting below the glass transition temperature in shocked polymers

Interplay of Mechanochemistry and Material Processes in the Graphite to Diamond Phase Transformation

Unsupervised Learning-Based Multiscale Model of Thermochemistry in 1,3,5-Trinitro-1,3,5-triazinane (RDX)

Systematic Builder for All‐Atom Simulations of Plastically Bonded Explosives

Predicted Reaction Mechanisms, Product Speciation, Kinetics, and Detonation Properties of the Insensitive Explosive 2,6-Diamino-3,5-dinitropyrazine-1-oxide (LLM-105)

Erratum: Continuum and molecular dynamics simulations of pore collapse in shocked β-tetramethylene tetranitramine (β-HMX) single crystals. [J. Appl. Phys. 129, 015904 (2021)]

Intergranular Hotspots: A Molecular Dynamics Study on the Influence of Compressive and Shear Work

Hotspot formation due to shock-induced pore collapse in 1,3,5,7-tetranitro-1,3,5,7-tetrazoctane (HMX): Role of pore shape and shock strength in collapse mechanism and temperature

Many-body mechanochemistry: Intramolecular strain in condensed matter chemistry

The Potential Energy Hotspot: Effects of Impact Velocity, Defect Geometry, and Crystallographic Orientation

Intergranular Hotspots: A Molecular Dynamics Study on the Influence of Compressive and Shear Work

A Hotspot’s Better Half: Non-Equilibrium Intra-Molecular Strain in Shock Physics

Rapid activation of non-oriented mechanophores via shock loading and spallation

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