High-Pressure Vibrational Spectroscopy of Energetic Materials:  Hexahydro-1,3,5-trinitro-1,3,5-triazine

Jennifer A. Ciezak; Timothy A. Jenkins; Zhenxian Liu; Russell J. Hemley

doi:10.1021/jp063150q

High-Pressure Vibrational Spectroscopy of Energetic Materials: Hexahydro-1,3,5-trinitro-1,3,5-triazine

The Journal of Physical Chemistry A ◽

10.1021/jp063150q ◽

2007 ◽

Vol 111 (1) ◽

pp. 59-63 ◽

Cited By ~ 87

Author(s):

Jennifer A. Ciezak ◽

Timothy A. Jenkins ◽

Zhenxian Liu ◽

Russell J. Hemley

Keyword(s):

High Pressure ◽

Vibrational Spectroscopy ◽

Energetic Materials

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Surface Nonlinear Vibrational Spectroscopy of Energetic Materials: HMX

The Journal of Physical Chemistry C ◽

10.1021/jp066801r ◽

2007 ◽

Vol 111 (5) ◽

pp. 2235-2241 ◽

Cited By ~ 22

Author(s):

Eric Surber ◽

Aaron Lozano ◽

Alexei Lagutchev ◽

Hackjin Kim ◽

Dana D. Dlott

Keyword(s):

Vibrational Spectroscopy ◽

Energetic Materials

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Thermal expansivity of mantle relevant magnesium silicates derived from vibrational spectroscopy at high pressure

American Mineralogist ◽

10.2138/am-2000-2-301 ◽

2000 ◽

Vol 85 (2) ◽

pp. 270-278 ◽

Cited By ~ 27

Author(s):

Anastasia Chopelas

Keyword(s):

High Pressure ◽

Vibrational Spectroscopy ◽

Thermal Expansivity ◽

Magnesium Silicates

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Equation of state for the detonation products of energetic materials

Materials Express ◽

10.1166/mex.2021.2033 ◽

2021 ◽

Vol 11 (8) ◽

pp. 1269-1287

Author(s):

Xiangyu Huo ◽

Li Zhang ◽

Mingli Yang

Keyword(s):

Artificial Intelligence ◽

High Pressure ◽

Computer Simulations ◽

Energetic Materials ◽

Equations Of State ◽

Experiment Study ◽

Detonation Products ◽

Main Approach ◽

Practical Applications ◽

Integrated Theory

Energetic materials (EMs) are one of the necessities in many military and civilian applications. Measuring the thermodynamic behaviors of detonation products of EMs at high temperature and high pressure, their equations of state (EOSs) not only serve as a basis in the design of novel materials, but also provide valuable information for their practical applications. The EOS study has a long history, but keeps moving all the time. Various EMs have been developed, the EOS of detonation products provides abundant information in the thermochemistry, hydromechanics and detonation physics, which in turn feedbacks the development of novel EMs and their EOSs. With the development of experimental techniques and computer simulations, many EOSs have been proposed for various explosives in recent years. While experiments keep their fundamental roles, integrated theory-experiment study has become the main approach to the EOS establishment for novel EMs. Moreover, computer simulations based on interatomic and/or intermolecular interaction will have great potential in the future when big data and artificial intelligence are introduced into the field.

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