[go: up one dir, main page]
More Web Proxy on the site http://driver.im/

Xue et al., 2015 - Google Patents

Influence of dislocations on the shock sensitivity of RDX: molecular dynamics simulations by reactive force field

Xue et al., 2015

Document ID
7846434243054374032
Author
Xue X
Wen Y
Long X
Li J
Zhang C
Publication year
Publication venue
The Journal of Physical Chemistry C

External Links

Snippet

Molecular dynamics simulations of the chemical responses of shocked dislocation- contained and perfect (p) 1, 3, 5-trinitro-1, 3, 5-triazinane (RDX) crystals were performed using the ReaxFF force field combined with the multiscale shock technique. The shear …
Continue reading at pubs.acs.org (other versions)

Similar Documents

Publication Publication Date Title
Xue et al. Influence of dislocations on the shock sensitivity of RDX: molecular dynamics simulations by reactive force field
Wang et al. Thermal decomposition mechanism of CL-20 at different temperatures by ReaxFF reactive molecular dynamics simulations
Rom et al. Density-dependent liquid nitromethane decomposition: molecular dynamics simulations based on ReaxFF
Wood et al. Coupled thermal and electromagnetic induced decomposition in the molecular explosive αHMX; a reactive molecular dynamics study
Xue et al. Initial decay mechanism of the heated CL-20/HMX cocrystal: a case of the cocrystal mediating the thermal stability of the two pure components
Manaa et al. Nitrogen-rich heterocycles as reactivity retardants in shocked insensitive explosives
Zhang et al. Carbon cluster formation during thermal decomposition of octahydro-1, 3, 5, 7-tetranitro-1, 3, 5, 7-tetrazocine and 1, 3, 5-triamino-2, 4, 6-trinitrobenzene high explosives from ReaxFF reactive molecular dynamics simulations
Wen et al. Twin induced sensitivity enhancement of HMX versus shock: A molecular reactive force field simulation
An et al. Highly shocked polymer bonded explosives at a nonplanar interface: Hot-spot formation leading to detonation
Manaa et al. Decomposition of HMX at extreme conditions: A molecular dynamics simulation
An et al. Anisotropic shock sensitivity of cyclotrimethylene trinitramine (RDX) from compress-and-shear reactive dynamics
Wen et al. Cluster evolution at early stages of 1, 3, 5-triamino-2, 4, 6-trinitrobenzene under various heating conditions: a molecular reactive force field study
An et al. Initial steps of thermal decomposition of dihydroxylammonium 5, 5′-bistetrazole-1, 1′-diolate crystals from quantum mechanics
Ge et al. Initial decomposition of the condensed-phase β-HMX under shock waves: molecular dynamics simulations
Sakano et al. Role of Molecular Disorder on the Reactivity of RDX
Han et al. Thermal decomposition of condensed-phase nitromethane from molecular dynamics from ReaxFF reactive dynamics
Islam et al. Reactive molecular dynamics simulations to investigate the shock response of liquid nitromethane
Chen et al. Thermal decomposition mechanism of 2, 2′, 4, 4′, 6, 6′-hexanitrostilbene by ReaxFF reactive molecular dynamics simulations
Rom et al. First-principles-based reaction kinetics for decomposition of hot, dense liquid TNT from ReaxFF multiscale reactive dynamics simulations
Isayev et al. Ab initio molecular dynamics study on the initial chemical events in nitramines: thermal decomposition of CL-20
He et al. Dynamic responses and initial decomposition under shock loading: a DFTB calculation combined with MSST method for β-HMX with molecular vacancy
Deng et al. Nature of the enhanced self-heating ability of imperfect energetic crystals relative to perfect ones
Xiao et al. Molecular dynamics study on the correlation between structure and sensitivity for defective RDX crystals and their PBXs
Sharia et al. Surface-accelerated decomposition of δ-HMX
Sharia et al. Surface-enhanced decomposition kinetics of molecular materials illustrated with cyclotetramethylene-tetranitramine