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Theoretical chemistry & modeling

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Explosives Decomposition Chemistry

High-energy materials are commonly used as military explosives and as advanced propellants. The detailed chemical reactions responsible for detonation

Publications

Topology, Landscapes, and Biomolecular Energy Transport

Author(s)
Justin E. Elenewski, Kirill Velizhanin, Michael P. Zwolak
While ubiquitous, energy redistribution remains a poorly understood facet of the nonequilibrium thermodynamics of biomolecules. At the molecular level, finite

Thermophysical Properties of Polyol Ester Lubricants

Author(s)
Thomas J. Bruno, Tara J. Fortin, Marcia L. Huber, Arno D. Laesecke, Eric W. Lemmon, Elisabeth Mansfield, Mark O. McLinden, Stephanie L. Outcalt, Richard A. Perkins, Kimberly N. Urness, Jason A. Widegren
This report summarizes the results of work performed for the Naval Air Warfare Center Aircraft Division by the National Institute of Standards and Technology