Keynote
Molecular Dynamical Simulations of Energetic Materials: Mechanism, THz Spectroscopy and Laser Ablation

Chemical reactivity of energetic materials is explored from an atomistic viewpoint.

Molecular dynamical simulation are employed to study the mechanism of decompostion of energetic matrials.

David Furman, Ronnie Kosloff, Faina Dubnikova, Sergey V Zybin, William A Goddard, Naomi Rom, Barak Hirshberg, and Yehuda Zeiri Decomposition of condensed phase energetic materials: Interplay between uni- and bimolecular mechanisms Applied to Explosive Crystals,
J. Am. Chem. Soc. 136, 4192 (2014).

We study the mechanism of laser ablation

David Furman, Ronnie Kosloff, and Yehuda Zeiri,Mechanism of intact adsorbed molecules ejection using high intensity laser pulses, J. Phys. Chem. C 120, 11306 (2016)

And suggest a ne non-linear THz spectroscopy:

Gil Katz, Sergey V. Zybin, William Goddard III, Yehuda Zeiri, Ronnie Kosloff,

Direct MD Simulations of Terahertz Absorption and 2-D Spectroscopy Applied to Explosive Crystals,
J. Phys. Chem. Lett. 5, 772 (2014).

Study a novel sensative mechanism

David Furman, Ronnie Kosloff and Yehuda Zeiri

The Journal of Physical Chemistry C, 120, 28886 (2016).