A molecular dynamics simulation study of crystalline 1,3,5-triamino-2,4,6-trinitrobenzene as a function of pressure and temperature
Bedrov, Dmitry, Borodin, Oleg, Smith, Grant D, Sewell, Thomas D, Dattelbaum, Dana M, Stevens, Lewis L
Published in The Journal of chemical physics (14.12.2009)
Published in The Journal of chemical physics (14.12.2009)
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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 coarse-grained simulations of shock waves in polyatomic molecular crystals
Kroonblawd, Matthew P, Sewell, Thomas D, Maillet, Jean-Bernard
Published in The Journal of chemical physics (14.02.2016)
Published in The Journal of chemical physics (14.02.2016)
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Predicted Anisotropic Thermal Conductivity for Crystalline 1,3,5-Triamino-2,4,6-trinitobenzene (TATB): Temperature and Pressure Dependence and Sensitivity to Intramolecular Force Field Terms
Kroonblawd, Matthew P., Sewell, Thomas D.
Published in Propellants, explosives, pyrotechnics (01.06.2016)
Published in Propellants, explosives, pyrotechnics (01.06.2016)
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Molecular dynamics simulations of shock waves in oriented nitromethane single crystals
He, Lan, Sewell, Thomas D, Thompson, Donald L
Published in The Journal of chemical physics (28.03.2011)
Published in The Journal of chemical physics (28.03.2011)
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Calculation of anharmonic couplings and THz linewidths in crystalline PETN
Pereverzev, Andrey, Sewell, Thomas D, Thompson, Donald L
Published in The Journal of chemical physics (14.03.2014)
Published in The Journal of chemical physics (14.03.2014)
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