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| Creator | Title | Description | Subject | Date | ||
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 | Bedrov, Dmitro; Smith, Grant D. | Molecular dynamics simulations of HMX crystal polymorphs using a flexible molecule force field | Molecular dynamics simulations using a recently developed quantum chemistry-based atomistic force field [J. Phys. Chem. B 103 (1999) 3570] were performed in order to obtain unit cell parameters, coefficients of thermal expansion, and heats of sublimation for the three pure crystal polymorphs of octa... | HMX; Crystal polymorphs; Force field; Coefficients of thermal expansion; Heat of sublimation; Cell parameters | 2002 |
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