-
1
-
-
84911908378
-
A Comparative Study of the Structure, Energetic Performance and Stability of Nitro-NNO-azoxy Substituted Explosives
-
Wang, Y.; Li, S.; Li, Y.; Zhang, R.; Wang, D.; Pang, S. P. A Comparative Study of the Structure, Energetic Performance and Stability of Nitro-NNO-azoxy Substituted Explosives J. Mater. Chem. A 2014, 2, 20806-20813 10.1039/C4TA04716H
-
(2014)
J. Mater. Chem. A
, vol.2
, pp. 20806-20813
-
-
Wang, Y.1
Li, S.2
Li, Y.3
Zhang, R.4
Wang, D.5
Pang, S.P.6
-
2
-
-
84882241140
-
New Roles for 1,1-Diamino-2,2-dinitroethene (FOX-7): Halogenated FOX-7 and Azo-bis(diahaloFOX) as Energetic Materials and Oxidizers
-
Vo, T. T.; Zhang, J.; Parrish, D. A.; Twamley, B.; Shreeve, J. M. New Roles for 1,1-Diamino-2,2-dinitroethene (FOX-7): Halogenated FOX-7 and Azo-bis(diahaloFOX) as Energetic Materials and Oxidizers J. Am. Chem. Soc. 2013, 135, 11787-11790 10.1021/ja406629g
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 11787-11790
-
-
Vo, T.T.1
Zhang, J.2
Parrish, D.A.3
Twamley, B.4
Shreeve, J.M.5
-
3
-
-
77956086408
-
Bis[3-(5-nitroimino-1,2,4-triazolate)]-Based Energetic Salts: Synthesis and Promising Properties of a New Family of High-Density Insensitive Materials
-
Wang, R.; Xu, H.; Guo, Y.; Sa, R.; Shreeve, J. M. Bis[3-(5-nitroimino-1,2,4-triazolate)]-Based Energetic Salts: Synthesis and Promising Properties of a New Family of High-Density Insensitive Materials J. Am. Chem. Soc. 2010, 132, 11904-11905 10.1021/ja1055033
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 11904-11905
-
-
Wang, R.1
Xu, H.2
Guo, Y.3
Sa, R.4
Shreeve, J.M.5
-
4
-
-
79955002389
-
Trinitromethyl-Substituted 5-Nitro- or 3-Azo-1,2,4-triazoles: Synthesis, Characterization, and Energetic Properties
-
Thottempudi, V.; Gao, H.; Shreeve, J. M. Trinitromethyl-Substituted 5-Nitro- or 3-Azo-1,2,4-triazoles: Synthesis, Characterization, and Energetic Properties J. Am. Chem. Soc. 2011, 133, 6464-6471 10.1021/ja2013455
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 6464-6471
-
-
Thottempudi, V.1
Gao, H.2
Shreeve, J.M.3
-
5
-
-
83055197003
-
Synthesis and Promising Properties of a New Family of High-Density Energetic Salts of 5-Nitro-3-trinitromethyl-1H-1,2,4-triazole and 5,5′-Bis(trinitromethyl)-3,3′-azo-1H-1,2,4-triazole
-
Thottempudi, V.; Shreeve, J. M. Synthesis and Promising Properties of a New Family of High-Density Energetic Salts of 5-Nitro-3-trinitromethyl-1H-1,2,4-triazole and 5,5′-Bis(trinitromethyl)-3,3′-azo-1H-1,2,4-triazole J. Am. Chem. Soc. 2011, 133, 19982-19992 10.1021/ja208990z
-
(2011)
J. Am. Chem. Soc.
, vol.133
, pp. 19982-19992
-
-
Thottempudi, V.1
Shreeve, J.M.2
-
6
-
-
77958504475
-
Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates
-
Joo, Y.-H.; Shreeve, J. M. Nitroimino-tetrazolates and Oxy-nitroimino-tetrazolates J. Am. Chem. Soc. 2010, 132, 15081-15090 10.1021/ja107729c
-
(2010)
J. Am. Chem. Soc.
, vol.132
, pp. 15081-15090
-
-
Joo, Y.-H.1
Shreeve, J.M.2
-
7
-
-
84896525731
-
3,3′-Dinitroamino-4,4′-azoxyfurazan and Its Derivatives: An Assembly of Diverse N-O Building Blocks for High-Performance Energetic Materials
-
Zhang, J.; Shreeve, J. M. 3,3′-Dinitroamino-4,4′-azoxyfurazan and Its Derivatives: An Assembly of Diverse N-O Building Blocks for High-Performance Energetic Materials J. Am. Chem. Soc. 2014, 136, 4437-4445 10.1021/ja501176q
-
(2014)
J. Am. Chem. Soc.
, vol.136
, pp. 4437-4445
-
-
Zhang, J.1
Shreeve, J.M.2
-
8
-
-
79954564974
-
Simulations of High-Pressure Phases in RDX
-
Munday, L. B.; Chung, P. W.; Rice, B. M.; Solares, S. D. Simulations of High-Pressure Phases in RDX J. Phys. Chem. B 2011, 115, 4378-4386 10.1021/jp112042a
-
(2011)
J. Phys. Chem. B
, vol.115
, pp. 4378-4386
-
-
Munday, L.B.1
Chung, P.W.2
Rice, B.M.3
Solares, S.D.4
-
9
-
-
84878652320
-
Direct Detection of RDX Vapor Using a Conjugated Polymer Network
-
Gopalakrishnan, D.; Dichtel, W. R. Direct Detection of RDX Vapor Using a Conjugated Polymer Network J. Am. Chem. Soc. 2013, 135, 8357-8362 10.1021/ja402668e
-
(2013)
J. Am. Chem. Soc.
, vol.135
, pp. 8357-8362
-
-
Gopalakrishnan, D.1
Dichtel, W.R.2
-
10
-
-
33748626423
-
The Application of Analytical Methods to the Detection of Hidden Explosives and Explosive Devices
-
Kolla, P. The Application of Analytical Methods to the Detection of Hidden Explosives and Explosive Devices Angew. Chem., Int. Ed. Engl. 1997, 36, 800-811 10.1002/anie.199708001
-
(1997)
Angew. Chem., Int. Ed. Engl.
, vol.36
, pp. 800-811
-
-
Kolla, P.1
-
12
-
-
84879980518
-
Nitrogen-rich Salts Based on 5-hydrazino-1H-tetrazole: A New Family of High-density Energetic Materials
-
Lin, Q. H.; Li, Y. C.; Qi, C.; Liu, W.; Wang, Y.; Pang, S. P. Nitrogen-rich Salts Based on 5-hydrazino-1H-tetrazole: A New Family of High-density Energetic Materials J. Mater. Chem. A 2013, 1, 6776-6785 10.1039/c3ta10503b
-
(2013)
J. Mater. Chem. A
, vol.1
, pp. 6776-6785
-
-
Lin, Q.H.1
Li, Y.C.2
Qi, C.3
Liu, W.4
Wang, Y.5
Pang, S.P.6
-
13
-
-
66749131150
-
-
Gaussian Inc: Wallingford, CT
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.;et al. Gaussian 03, Revision E.02. Gaussian Inc: Wallingford, CT, 2003.
-
(2003)
Gaussian 03, Revision E.02
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
-
14
-
-
0345491105
-
-
Lee, C.; Yang, W.; Parr, R. G. Phys. Rev. B: Condens. Matter Mater. Phys. 1988, 37, 785-789 10.1103/PhysRevB.37.785
-
(1988)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.37
, pp. 785-789
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
15
-
-
84856215640
-
Multiwfn: A Multifunctional Wavefunction Analyzer
-
Lu, T.; Chen, F. Multiwfn: A Multifunctional Wavefunction Analyzer J. Comput. Chem. 2012, 33, 580-592 10.1002/jcc.22885
-
(2012)
J. Comput. Chem.
, vol.33
, pp. 580-592
-
-
Lu, T.1
Chen, F.2
-
16
-
-
70349448483
-
An Electrostatic Interaction Correction for Improved Crystal Density Prediction
-
Politzer, P.; Martinez, J.; Murray, J. S.; Concha, M. C.; Toro-Labbé, A. An Electrostatic Interaction Correction for Improved Crystal Density Prediction Mol. Phys. 2009, 107, 2095-2101 10.1080/00268970903156306
-
(2009)
Mol. Phys.
, vol.107
, pp. 2095-2101
-
-
Politzer, P.1
Martinez, J.2
Murray, J.S.3
Concha, M.C.4
Toro-Labbé, A.5
-
17
-
-
79959245965
-
DFT Studies on High Energy Density Cage Compound 4-trinitroethyl-2,6,8,10,12-pentanitroheazaisowurtzitane
-
Zhang, J. Y.; Du, H. C.; Wang, F.; Gong, X. D.; Huang, Y. S. DFT Studies on High Energy Density Cage Compound 4-trinitroethyl-2,6,8,10,12-pentanitroheazaisowurtzitane J. Phys. Chem. A 2011, 115, 6617-6621 10.1021/jp1118822
-
(2011)
J. Phys. Chem. A
, vol.115
, pp. 6617-6621
-
-
Zhang, J.Y.1
Du, H.C.2
Wang, F.3
Gong, X.D.4
Huang, Y.S.5
-
18
-
-
0003516749
-
-
Oxford University Press: Oxford, U.K.
-
Atkins, P. W. Physical Chemistry; Oxford University Press: Oxford, U.K., 1982.
-
(1982)
Physical Chemistry
-
-
Atkins, P.W.1
-
19
-
-
0000414624
-
Calculation of Heats of Sublimation and Solid Phase Heats of Formation
-
Politzer, P.; Murray, J. S.; Grice, M. E.; DeSalvo, M.; Miller, E. Calculation of Heats of Sublimation and Solid Phase Heats of Formation Mol. Phys. 1997, 91, 923-928 10.1080/002689797171030
-
(1997)
Mol. Phys.
, vol.91
, pp. 923-928
-
-
Politzer, P.1
Murray, J.S.2
Grice, M.E.3
DeSalvo, M.4
Miller, E.5
-
20
-
-
84859142204
-
Some Perspectives on Estimating Detonation Properties of C, H, N, O Compounds
-
Politzer, P.; Murray, J. S. Some Perspectives on Estimating Detonation Properties of C, H, N, O Compounds Cent. Eur. J. Energy Mater. 2011, 8, 209-220
-
(2011)
Cent. Eur. J. Energy Mater.
, vol.8
, pp. 209-220
-
-
Politzer, P.1
Murray, J.S.2
-
21
-
-
33644509240
-
Improved Prediction of Heats of Formation of Energetic Materials Using Quantum Mechanical Calculations
-
Byrd, E. F. C.; Rice, B. M. Improved Prediction of Heats of Formation of Energetic Materials Using Quantum Mechanical Calculations J. Phys. Chem. A 2006, 110, 1005-1013 10.1021/jp0536192
-
(2006)
J. Phys. Chem. A
, vol.110
, pp. 1005-1013
-
-
Byrd, E.F.C.1
Rice, B.M.2
-
22
-
-
33947651444
-
Chemistry of Detonation. I. A Simple Method for Calculating Detonation Properties of C, H, N, O Explosives
-
Kamlet, M. J.; Jacobs, S. T. Chemistry of Detonation. I. A Simple Method for Calculating Detonation Properties of C, H, N, O Explosives J. Chem. Phys. 1968, 48, 23-35 10.1063/1.1667908
-
(1968)
J. Chem. Phys.
, vol.48
, pp. 23-35
-
-
Kamlet, M.J.1
Jacobs, S.T.2
-
23
-
-
77953925516
-
A Possible Crystal Volume Factor in the Impact Sensitivities of Some Energetic Compounds
-
Pospíšil, M.; Vávra, P.; Concha, M. C.; Murray, J. S.; Politzer, P. A Possible Crystal Volume Factor in the Impact Sensitivities of Some Energetic Compounds J. Mol. Model. 2010, 16, 895-901 10.1007/s00894-009-0587-x
-
(2010)
J. Mol. Model.
, vol.16
, pp. 895-901
-
-
Pospíšil, M.1
Vávra, P.2
Concha, M.C.3
Murray, J.S.4
Politzer, P.5
-
24
-
-
78650686058
-
-
Kosar, B.; Albayrak, C. Spectrochim. Acta, Part A 2011, 78, 160-167 10.1016/j.saa.2010.09.016
-
(2011)
Spectrochim. Acta, Part A
, vol.78
, pp. 160-167
-
-
Kosar, B.1
Albayrak, C.2
-
25
-
-
0034677028
-
Hepta- and Octanitrocubanes
-
Zhang, M. X.; Eaton, P. E.; Gilardi, R. Hepta- and Octanitrocubanes Angew. Chem., Int. Ed. 2000, 39, 401-404 10.1002/(SICI)1521-3773(20000117)39:2<401::AID-ANIE401>3.0.CO;2-P
-
(2000)
Angew. Chem., Int. Ed.
, vol.39
, pp. 401-404
-
-
Zhang, M.X.1
Eaton, P.E.2
Gilardi, R.3
-
26
-
-
0011083273
-
Harmonic Vibrational Frequencies: An Evaluation of Hartree-Fock, Møller-Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors
-
Scott, A. P.; Radom, L. Harmonic Vibrational Frequencies: An Evaluation of Hartree-Fock, Møller-Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors J. Phys. Chem. 1996, 100, 16502-16513 10.1021/jp960976r
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 16502-16513
-
-
Scott, A.P.1
Radom, L.2
-
27
-
-
0000323721
-
-
Simpson, R.; Urtiew, P.; Ornellas, D.; Moody, G.; Scribner, K.; Hoffman, D. Propellants, Explos., Pyrotech. 1997, 22, 249-255 10.1002/prep.19970220502
-
(1997)
Propellants, Explos., Pyrotech.
, vol.22
, pp. 249-255
-
-
Simpson, R.1
Urtiew, P.2
Ornellas, D.3
Moody, G.4
Scribner, K.5
Hoffman, D.6
-
28
-
-
16344370050
-
Aqueous Solubility and Alkaline Hydrolysis of the Novel High Explosive Hexanitrohexaazaisowurtzitane (CL-20)
-
Karakaya, P.; Sidhoum, M.; Christodoulatos, C.; Nicolich, S.; Balas, W. Aqueous Solubility and Alkaline Hydrolysis of the Novel High Explosive Hexanitrohexaazaisowurtzitane (CL-20) J. Hazard. Mater. 2005, 120, 183-191 10.1016/j.jhazmat.2005.01.001
-
(2005)
J. Hazard. Mater.
, vol.120
, pp. 183-191
-
-
Karakaya, P.1
Sidhoum, M.2
Christodoulatos, C.3
Nicolich, S.4
Balas, W.5
|