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Matthew Kroonblawd
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High explosive ignition through chemically activated nanoscale shear bands
MP Kroonblawd, LE Fried
Physical Review Letters 124 (20), 206002, 2020
542020
Theoretical determination of anisotropic thermal conductivity for crystalline 1, 3, 5-triamino-2, 4, 6-trinitrobenzene (TATB)
MP Kroonblawd, TD Sewell
The Journal of chemical physics 139 (7), 074503, 2013
532013
A generalized crystal-cutting method for modeling arbitrarily oriented crystals in 3D periodic simulation cells with applications to crystal–crystal interfaces
MP Kroonblawd, N Mathew, S Jiang, TD Sewell
Computer Physics Communications 207, 232-242, 2016
482016
Theoretical determination of anisotropic thermal conductivity for initially defect-free and defective TATB single crystals
MP Kroonblawd, TD Sewell
The Journal of Chemical Physics 141 (18), 184501, 2014
392014
Characteristics of energy exchange between inter-and intramolecular degrees of freedom in crystalline 1, 3, 5-triamino-2, 4, 6-trinitrobenzene (TATB) with implications for …
MP Kroonblawd, TD Sewell, JB Maillet
The Journal of Chemical Physics 144 (6), 064501, 2016
382016
Generating converged accurate free energy surfaces for chemical reactions with a force-matched semiempirical Model
MP Kroonblawd, F Pietrucci, AM Saitta, N Goldman
Journal of Chemical Theory and Computation 14 (4), 2207-2218, 2018
312018
Sensitivity of pore collapse heating to the melting temperature and shear viscosity of HMX
MP Kroonblawd, RA Austin
Mechanics of Materials 152, 103644, 2021
272021
Sensitivity of the shock initiation threshold of 1, 3, 5-triamino-2, 4, 6-trinitrobenzene (TATB) to nuclear quantum effects
BW Hamilton, MP Kroonblawd, MM Islam, A Strachan
The Journal of Physical Chemistry C 123 (36), 21969-21981, 2019
272019
Synthesis of functionalized nitrogen-containing polycyclic aromatic hydrocarbons and other prebiotic compounds in impacting glycine solutions
MP Kroonblawd, RK Lindsey, N Goldman
Chemical science 10 (24), 6091-6098, 2019
272019
Pressure-induced phase transition in 1, 3, 5-triamino-2, 4, 6-trinitrobenzene (TATB)
BA Steele, SM Clarke, MP Kroonblawd, IFW Kuo, PF Pagoria, ...
Applied Physics Letters 114 (19), 191901, 2019
262019
Anisotropic relaxation of idealized hot spots in crystalline 1, 3, 5-triamino-2, 4, 6-trinitrobenzene (TATB)
MP Kroonblawd, TD Sewell
The Journal of Physical Chemistry C 120 (31), 17214-17223, 2016
252016
Predicted Anisotropic Thermal Conductivity for Crystalline 1, 3, 5‐Triamino‐2, 4, 6‐trinitobenzene (TATB): Temperature and Pressure Dependence and Sensitivity to Intramolecular …
MP Kroonblawd, TD Sewell
Propellants, Explosives, Pyrotechnics 41 (3), 502-513, 2016
252016
Predicted melt curve and liquid-state transport properties of TATB from molecular dynamics simulations
N Mathew, MP Kroonblawd, T Sewell, DL Thompson
Molecular Simulation 44 (8), 613-622, 2018
212018
A molecular dynamics simulation study of thermal conductivity anisotropy in β-octahydro-1, 3, 5, 7-tetranitro-1, 3, 5, 7-tetrazocine (β-HMX)
R Chitsazi, MP Kroonblawd, A Pereverzev, T Sewell
Modelling and Simulation in Materials Science and Engineering 28 (2), 025008, 2020
192020
Chemical degradation pathways in siloxane polymers following phenyl excitations
MP Kroonblawd, N Goldman, JP Lewicki
The Journal of Physical Chemistry B 122 (50), 12201-12210, 2018
182018
Mechanochemical formation of heterogeneous diamond structures during rapid uniaxial compression in graphite
MP Kroonblawd, N Goldman
Physical Review B 97 (18), 184106, 2018
182018
A Hotspots Better Half: Non-Equilibrium Intra-Molecular Strain in Shock Physics
BW Hamilton, MP Kroonblawd, C Li, A Strachan
The Journal of Physical Chemistry Letters 12, 2756, 2021
172021
Predicted reaction mechanisms, product speciation, kinetics, and detonation properties of the insensitive explosive 2, 6-diamino-3, 5-dinitropyrazine-1-oxide (llm-105)
BW Hamilton, BA Steele, MN Sakano, MP Kroonblawd, IFW Kuo, ...
The Journal of Physical Chemistry A 125 (8), 1766-1777, 2021
162021
Mechanochemical synthesis of glycine oligomers in a virtual rotational diamond anvil cell
BA Steele, N Goldman, IFW Kuo, MP Kroonblawd
Chemical Science 11 (30), 7760-7771, 2020
152020
Role of filler and its heterostructure on moisture sorption mechanisms in polyimide films
HN Sharma, MP Kroonblawd, Y Sun, EA Glascoe
Scientific Reports 8 (1), 16889, 2018
132018
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