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15th APS Topical Conference on Shock Compression of Condensed Matter

Sunday–Friday, June 24–29, 2007; Kohala Coast, Hawaii

Session C2: First Principles and Molecular Dynamics Calculations I

Show Abstracts

Chair: Carter White, Naval Research Laboratory
Fairmont Orchid Hotel - Amphitheater

Monday, June 25, 2007 1:45PM - 2:00PM	C2.00001: Anisotropic constitutive relationships in energetic materials: nitromethane, RDX, and TATB Ivan Oleynik , Michael Conroy , Carter White Preview Abstract
Monday, June 25, 2007 2:00PM - 2:15PM	C2.00002: Molecular simulations of Crussard curves of detonation product mixtures at chemical equilibrium: Microscopic calculation of the Chapman-Jouguet state Emeric Bourasseau , Vincent Dubois , Nicolas Desbiens , Jean-Bernard Maillet Preview Abstract
Monday, June 25, 2007 2:15PM - 2:30PM	C2.00003: Ab Initio Equation of State for $\beta $-HMX Frank Zerilli , Maija Kuklja Preview Abstract
Monday, June 25, 2007 2:30PM - 2:45PM	C2.00004: Anisotropic constitutive relationships in energetic materials: PETN and HMX Michael Conroy , Ivan Oleynik , Sergey Zybin , Carter White Preview Abstract
Monday, June 25, 2007 2:45PM - 3:00PM	C2.00005: First principles calculation of the structure and vibrational modes for RDX crystals under static and shock compression M.S. Miao , Z.A. Dreger , J.M. Winey , Y.M. Gupta Preview Abstract
Monday, June 25, 2007 3:00PM - 3:15PM	C2.00006: Calculation of RDX molecular crystal geometry and vibrational frequencies under hydrostatic pressure Warren Perger , Wil Slough Preview Abstract