Skip to main content
U.S. Department of Energy
Office of Scientific and Technical Information

Molecular Inclusion of Small Aging Products into the Hexanitrohexaazaisowurtzitane (CL-20) Lattice: Part I, Infrared Spectra

Journal Article · · Propellants, Explosives, Pyrotechnics

Abstract not provided.

Research Organization:
Sandia National Laboratories (SNL-NM), Albuquerque, NM (United States)
Sponsoring Organization:
USDOE National Nuclear Security Administration (NNSA)
Grant/Contract Number:
NA0003525
OSTI ID:
1870454
Alternate ID(s):
OSTI ID: 1870474
Report Number(s):
SAND2022-3983J; 704596
Journal Information:
Propellants, Explosives, Pyrotechnics, Journal Name: Propellants, Explosives, Pyrotechnics Journal Issue: 5 Vol. 47; ISSN 0721-3115
Publisher:
WileyCopyright Statement
Country of Publication:
United States
Language:
English

References (57)

Comparative Investigation of Thermal Decomposition of Various Modifications of Hexanitrohexaazaisowurtzitane (CL-20) journal November 2000
Kinetic Description of Mass Loss Data for the Assessment of Stability, Compatibility and Aging of Energetic Components and Formulations Exemplified with e-CL20 journal June 2002
Hydrogen Peroxide Solvates of 2,4,6,8,10,12-Hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane journal October 2016
Host-Guest Inclusion Compound from Nitramine Crystals Exposed to Condensed Carbon Dioxide journal October 2010
Improved grid-based algorithm for Bader charge allocation journal January 2007
The thermal stability of the polymorphs of hexanitrohexaazaisowurtzitane, Part I journal February 1994
Thermal Stability of ?-Hexanitrohexaazaisowurtzitane in an Estane Formulation journal April 1994
The thermal stability of the polymorphs of hexanitrohexaazaisowurtzitane, part II journal June 1994
CL-20 performance exceeds that of HMX and its sensitivity is moderate journal October 1997
Kinetics of thermal decomposition of hexanitrohexaazaisowurtzitane journal May 2000
Investigation on the thermal expansion of α-CL-20 with different water contents journal July 2015
The near-infrared absorption spectrum of nitrous oxide: analysis of the 5ν3andν1 + 5ν3 clusters journal September 1996
Thermal decomposition of energetic materials 53. Kinetics and mechanism of thermolysis of hexanitrohexazaisowurtzitane journal November 1991
VMD: Visual molecular dynamics journal February 1996
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set journal July 1996
Heterogeneous reactions of NO2 and NO–O2 on the surface of carbons journal February 2003
Synthesis of polyazapolycyclic caged polynitramines journal September 1998
Infrared spectrum of solid isocyanic acid (HNCO): vibrational assignments and integrated band intensities journal January 2002
A fast and robust algorithm for Bader decomposition of charge density journal June 2006
Aqueous solubility and alkaline hydrolysis of the novel high explosive hexanitrohexaazaisowurtzitane (CL-20) journal April 2005
Studies on thermal decomposition mechanism of CL-20 by pyrolysis gas chromatography–mass spectrometry (Py-GC/MS) journal November 2008
Are 1,5- and 1,7-dihydrodiimidazo[4,5-b:4′,5′-e]pyrazine the main products of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane (CL-20) alkaline hydrolysis? A DFT study of vibrational spectra journal August 2006
An analysis of stable forms of CL-20: A DFT study of conformational transitions, infrared and Raman spectra journal October 2007
Thermal study of HNIW (CL-20) journal August 2005
Photodegradation of CL-20: insights into the mechanisms of initial reactions and environmental fate journal November 2004
Insight into the Chemistry of PETN Under Shock Compression Through Ultrafast Broadband Mid-Infrared Absorption Spectroscopy journal August 2020
Experimental and Theoretical Study on the Stability of CL-20-Based Host–Guest Energetic Materials journal July 2020
Alkaline Hydrolysis of the Cyclic Nitramine Explosives RDX, HMX, and CL-20:  New Insights into Degradation Pathways Obtained by the Observation of Novel Intermediates journal May 2003
Pressure/temperature phase diagram of hexanitrohexaazaisowurtzitane journal March 1993
EPR spectra of photochemical nitrogen dioxide formation in monocyclic nitramines and hexanitrohexaazaisowurtzitane journal July 1991
Reaction of hexane soot with nitrogen dioxide/nitrogen oxide (N2O4) journal October 1984
Harmonic Vibrational Frequencies:  An Evaluation of Hartree−Fock, Møller−Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors journal January 1996
Semiempirical Predictions of Chemical Degradation Reaction Mechanisms of CL-20 as Related to Molecular Structure journal October 2004
Efficient MOF-based degradation of organophosphorus compounds in non-aqueous environments journal January 2018
Host–guest energetic materials constructed by incorporating oxidizing gas molecules into an organic lattice cavity toward achieving highly-energetic and low-sensitivity performance journal January 2019
Insight into the roles of small molecules in CL-20 based host–guest crystals: a comparative DFT-D study journal January 2020
Accurate and efficient algorithm for Bader charge integration journal February 2011
Vibrational and dielectric properties of C 60 from density‐functional perturbation theory journal June 1994
The Electronic Structure of the Normal Nitrous Oxide Molecule journal July 1932
The Compressibility of Media under Extreme Pressures journal September 1944
Hydrolysis of Hexanitrohexaazaisowurtzitane (CL-20) journal January 2007
Prediction of CL-20 chemical degradation pathways, theoretical and experimental evidence for dependence on competing modes of reaction journal October 2005
A grid-based Bader analysis algorithm without lattice bias journal January 2009
Special points for Brillouin-zone integrations journal June 1976
Ab initiomolecular dynamics for liquid metals journal January 1993
Ab initio molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium journal May 1994
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set journal October 1996
From ultrasoft pseudopotentials to the projector augmented-wave method journal January 1999
Accurate Molecular Van Der Waals Interactions from Ground-State Electron Density and Free-Atom Reference Data journal February 2009
Generalized Gradient Approximation Made Simple journal October 1996
The kinetics of the polymorphic transition of the α-form of 2,4,6,8,10,12-hexanitrohexaazaisowurtzitane journal January 2009
The energy parameters of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazaisowurtzitane polymorphs and their phase transitions journal January 2009
Avogadro: an advanced semantic chemical editor, visualization, and analysis platform journal August 2012
Crystallization Behavior of Hexanitrohexaazaisowurtzitane at 298K and Quantitative Analysis of Mixtures of Its Polymorphs by FTIR. journal January 1998
Crystal structure of 2,4,6,8,10,12-hexanitro-2,4,6,8,10,12-hexaazatetracyclo[5·5·0·0 5·9 ·0 3·11 ]dodecane 1/3 hydrate, C 6 H 8 N 12 O 13 journal February 2016
Controlling the microstructure of vapor-deposited pentaerythritol tetranitrate films journal June 2011
Hygroscopicity of optical glasses as an indicator of serviceability journal April 1946

Similar Records

Nitrogen‐Nitrogen Bond Breaking in Irradiation Products of Hexanitrohexaazaisowurtzitane (CL‐20)
Journal Article · Sun Oct 27 00:00:00 EDT 2024 · Propellants, Explosives, Pyrotechnics · OSTI ID:2584755

Electrospray Ionization Mass Spectrometry of hexanitrohexaazaisowurtzitane (CL-20)
Journal Article · Mon Sep 03 00:00:00 EDT 2007 · Analytical Letters, 40(10):1972-1978 · OSTI ID:921369

Related Subjects