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Phase Transitions and Mechanical Properties of Octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine in Different Crystal Phases by Molecular Dynamics Simulation
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What this work says
Outgoing claims: the papers this work cites, builds on, or argues with.
inferredcites →https://doi.org/10.1016/0167-7322(88)80022-9openalex-snapshot
Computer Simulation of Liquids
inferredcites →https://doi.org/10.1021/j100463a015openalex-snapshot
Pressure-temperature dependence of the .beta.-.delta. polymorph interconversion in octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine
inferredcites →https://doi.org/10.1021/j100506a011openalex-snapshot
Pressure dependence of the Raman and infrared spectra of .alpha.-, .beta.-, .gamma.-, and .delta.-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine
inferredcites →https://doi.org/10.1021/jp040472qopenalex-snapshot
Theoretical Studies on the Vibrational Spectra, Thermodynamic Properties, Detonation Properties, and Pyrolysis Mechanisms for Polynitroadamantanes
inferredcites →https://doi.org/10.1021/jp060077vopenalex-snapshot
Molecular Dynamics Simulations for Pure ε-CL-20 and ε-CL-20-Based PBXs
inferredcites →https://doi.org/10.1021/jp061707wopenalex-snapshot
Ab Initio and Molecular Dynamics Studies of Crystalline TNAD (trans-1,4,5,8-Tetranitro-1,4,5,8-tetraazadecalin)
inferredcites →https://doi.org/10.1021/jp0617930openalex-snapshot
Ab Initio Study of Compressed 1,3,5,7-Tetranitro-1,3,5,7-tetraazacyclooctane (HMX), Cyclotrimethylenetrinitramine (RDX), 2,4,6,8,10,12-Hexanitrohexaazaisowurzitane (CL-20), 2,4,6-Trinitro-1,3,5-benzenetriamine (TATB), and Pentaerythritol Tetranitrate (PETN)
inferredcites →https://doi.org/10.1021/jp065430bopenalex-snapshot
Molecular Dynamics Simulations of trans -1,4,5,8-Tetranitro-1,4,5,8-tetraazadecalin-Based Polymer-Bonded Explosives
inferredcites →https://doi.org/10.1021/jp070863fopenalex-snapshot
Theoretical Studies of Solid Bicyclo-HMX: Effects of Hydrostatic Pressure and Temperature
inferredcites →https://doi.org/10.1021/jp075056vopenalex-snapshot
First-Principles Study of the Four Polymorphs of Crystalline Octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine
inferredcites →https://doi.org/10.1021/jp980939vopenalex-snapshot
COMPASS: An ab Initio Force-Field Optimized for Condensed-Phase ApplicationsOverview with Details on Alkane and Benzene Compounds
inferredcites →https://doi.org/10.1021/jp981661+openalex-snapshot
Isothermal−Isobaric Molecular Dynamics Simulations of 1,3,5,7-Tetranitro-1,3,5,7-tetraazacyclooctane (HMX) Crystals
inferredcites →https://doi.org/10.1021/jp9926037openalex-snapshot
Electronic Structure Calculation of the Structures and Energies of the Three Pure Polymorphic Forms of Crystalline HMX
inferredcites →https://doi.org/10.1063/1.1599273openalex-snapshot
A molecular dynamics simulation study of elastic properties of HMX
inferredcites →https://doi.org/10.1063/1.1856227openalex-snapshot
Isothermal equations of state of beta octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine at high temperatures
inferredcites →https://doi.org/10.1063/1.1883627openalex-snapshot
The elastic constants and related properties of β-HMX determined by Brillouin scattering
inferredcites →https://doi.org/10.1063/1.328693openalex-snapshot
Polymorphic transitions in single crystals: A new molecular dynamics method
inferredcites →https://doi.org/10.1063/1.367168openalex-snapshot
Monte Carlo calculations of the hydrostatic compression of hexahydro-1,3,5-trinitro-1,3,5-triazine and β-octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine
inferredcites →https://doi.org/10.1063/1.439486openalex-snapshot
Molecular dynamics simulations at constant pressure and/or temperature
inferredcites →https://doi.org/10.1063/1.448118openalex-snapshot
Molecular dynamics with coupling to an external bath
inferredcites →https://doi.org/10.1063/1.480341openalex-snapshot
Equation of state, phase transition, decomposition of β-HMX (octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine) at high pressures
inferredcites →https://doi.org/10.1080/00268970802616343openalex-snapshot
The first principle studies of the structural and vibrational properties of solid β-HMX under compression
inferredcites →https://doi.org/10.1080/00268970903313642openalex-snapshot
The pressure-induced phase transition of the solid β–HMX
inferredcites →https://doi.org/10.1080/01418618208239905openalex-snapshot
A quantitative demonstration of the grain boundary diffusion mechanism for the oxidation of metals
inferredcites →https://doi.org/10.1080/14786440808520496openalex-snapshot
XCII. Relations between the elastic moduli and the plastic properties of polycrystalline pure metals
inferredcites →https://doi.org/10.1093/oso/9780198803195.001.0001openalex-snapshot
Computer Simulation of Liquids
inferredcites →https://doi.org/10.1107/s0108270185007739openalex-snapshot
Structure of the fourth form of 1,3,5,7-tetranitro-1,3,5,7-tetraazacyclooctane (γ-HMX), 2C4H8N8O8.0.5H2O
inferredcites →https://doi.org/10.1107/s0365110x63001651openalex-snapshot
The crystal structure of α-HMX and a refinement of the structure of β-HMX
inferredcites →https://doi.org/10.1107/s0567740870003941openalex-snapshot
A study of the crystal structure of β-cyclotetramethylene tetranitramine by neutron diffraction
inferredcites →https://doi.org/10.1107/s056774087400611xopenalex-snapshot
The crystal structure of the δ-form of 1,3,5,7-tetranitro-1,3,5,7-tetraazacyclooctane (δ-HMX)
inferredcites →https://doi.org/10.1115/1.3167709openalex-snapshot
Statistical Mechanics of Elasticity
inferredcites →https://doi.org/10.1179/026708392790170801openalex-snapshot
Theoretical predictions of structure and related properties of intermetallics
inferredcites →https://doi.org/10.1360/982004-147openalex-snapshot
Simulation investigations in the binding energy and me-chanical properties of HMX-based polymer-bonded explosives
What points at this work
Incoming claims: where this work appears in other papers’ reference lists and arguments.
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An Anisotropic Elastoviscoplasticity Model of Thermomechanical Responses of Shocked β‐HMX and α‐RDX Single Crystals
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Molecular dynamics simulations of void defects in the energetic material HMX
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Quantum-Informed Multiscale M&S for Energetic Materials
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Structural stability of nano-sized crystals of HMX: A molecular dynamics simulation study
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Probing impact of molecular structure on bulk modulus and impact sensitivity of energetic materials by machine learning methods
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Study on structure, sensitivity and mechanical properties of HMX and HMX-based PBXs with molecular dynamics simulation
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Ab-initio molecular dynamics study on chemical decomposition reaction of α-HMX
inferred← citeshttps://doi.org/10.1016/j.dt.2021.09.010openalex-snapshot
Shock response of cyclotetramethylene tetranitramine (HMX) single crystal at elevated temperatures
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Molecular perovskites as a new platform for designing advanced multi-component energetic crystals
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A fully coupled thermomechanical dislocation model for explosive crystal (β-HMX) subjected to isentropic compression loading
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Anisotropic mechanical-thermal-phase transformation response of cyclotetramethylene tetranitramine (HMX) single crystal under ramp loading
inferred← citeshttps://doi.org/10.1016/j.ijsolstr.2021.111170openalex-snapshot
Atomistic-model informed pressure-sensitive crystal plasticity for crystalline HMX
inferred← citeshttps://doi.org/10.1016/j.ijsolstr.2024.113085openalex-snapshot
A non-isothermal breakage-damage model for plastic-bonded granular materials incorporating temperature, pressure, and rate dependencies
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Molecular dynamics simulations to calculate glass transition temperature and elastic constants of novel polyethers
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Continuum Modeling Predictions of Nonlinear Specific Heat in Phase Transition of Energetic Materials
inferred← citeshttps://doi.org/10.1016/j.mechmat.2019.103079openalex-snapshot
Plastic dissipation sensitivity to mechanical properties in polycrystalline β-HMX subjected to impact loading
inferred← citeshttps://doi.org/10.1016/j.mechrescom.2023.104156openalex-snapshot
Prediction of nonlinear specific heat during single crystal HMX phase transition
inferred← citeshttps://doi.org/10.1016/j.mtcomm.2026.115423openalex-snapshot
Structural and elastic properties of cyclotetramethylene tetranitramine (β-HMX) from a machine learning force field
inferred← citeshttps://doi.org/10.1016/j.physb.2011.03.062openalex-snapshot
Structure, equation of state and elasticity of crystalline HNIW by molecular dynamics simulations
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Construction of Typical Nitroamine Explosives Lamellae and Their Morphology Effect Responding to Mechanical Stimuli
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Predicting Elastic Properties of β-HMX from First-Principles Calculations
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Phase Transition in Octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine (HMX) under Static Compression: An Application of the First-Principles Method Specialized for CHNO Solid Explosives
inferred← citeshttps://doi.org/10.1021/acs.jpcc.0c01567openalex-snapshot
Microscopic Mechanisms of Femtosecond Laser Ablation of HMX from Reactive Molecular Dynamics Simulations
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A Deep Neural Network Potential Study on the Mechanical and Thermophysical Properties of β-HMX Molecular Crystal
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Facile, continuous and large-scale synthesis of CL-20/HMX nano co-crystals with high-performance by ultrasonic spray-assisted electrostatic adsorption method
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Numerical simulation analyses of β ↔ δ phase transition for a finite-sized HMX single crystal subjected to thermal loading
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Theoretical study of the thermodynamic properties, phase transition wave, and phase transition velocity for octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine
inferred← citeshttps://doi.org/10.1063/1674-0068/26/04/462-466openalex-snapshot
Mesoscopic Simulation of Aggregate Behaviour of Polymers in β-HMX-based PBXs
inferred← citeshttps://doi.org/10.3390/books978-3-03921-671-0openalex-snapshot
First-Principles Prediction of Structures and Properties in Crystals
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Van der Waals Density Functional Theory vdW-DFq for Semihard Materials
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