-
1
-
-
0004096493
-
-
2 nd ed. The Royal Society of Chemistry: Cambridge, U.K.
-
Akhavan, J. The Chemistry of Explosives, 2 nd ed.; The Royal Society of Chemistry: Cambridge, U.K., 2004.
-
(2004)
The Chemistry of Explosives
-
-
Akhavan, J.1
-
2
-
-
0035164856
-
Design and synthesis of energetic materials
-
DOI 10.1146/annurev.matsci.31.1.291
-
Fried, L. E.; Manaa, M. R.; Pagoria, P. F.; Simpson, R. L. Design and Synthesis of Energetic Materials Annu. Rev. Mater. Res. 2001, 31, 291-321 (Pubitemid 33073852)
-
(2001)
Annual Review of Materials Science
, vol.31
, pp. 291-321
-
-
Fried, L.E.1
Manaa, M.R.2
Pagoria, P.F.3
Simpson, R.L.4
-
3
-
-
0343196865
-
Influence of RDX Crystal Shape on the Shock Sensitivity of PBXs
-
van der Steen, A. C.; Verbeek, H. J.; Meulenbrugge, J. J. In Influence of RDX Crystal Shape on the Shock Sensitivity of PBXs. Proceedings of the 9th International Symposium on Detonation, Portland, Oregon, 1989; pp 83-88.
-
(1989)
Proceedings of the 9th International Symposium on Detonation, Portland, Oregon
, pp. 83-88
-
-
Van Der Steen, A.C.1
Verbeek, H.J.2
Meulenbrugge, J.J.3
-
4
-
-
36549095790
-
Crystal Size Dependence for Impact in Initiation of Cyclotrimethylenetrinitramine Explosive
-
Armstrong, R. W.; Coffey, C. S.; DeVost, V. F.; Elban, W. L. Crystal Size Dependence for Impact in Initiation of Cyclotrimethylenetrinitramine Explosive J. Appl. Phys. 1990, 68, 979-984
-
(1990)
J. Appl. Phys.
, vol.68
, pp. 979-984
-
-
Armstrong, R.W.1
Coffey, C.S.2
Devost, V.F.3
Elban, W.L.4
-
5
-
-
74949126468
-
Predicting the Effect of Porosity on the Shock Sensitivity of Explosives
-
American Institute of Physics: Melville, New York
-
Handley, C. A.; Lambourn, B. D. Predicting the Effect of Porosity on the Shock Sensitivity of Explosives. Shock Compression of Condensed Matter 2009: Proceedings of the American Physical Society Topical Group on Shock Compression of Condensed Matter, Nashville, TN, 28 June-3 July 2009; American Institute of Physics: Melville, New York, 2009; pp 221-224.
-
(2009)
Shock Compression of Condensed Matter 2009: Proceedings of the American Physical Society Topical Group on Shock Compression of Condensed Matter, Nashville, TN, 28 June-3 July 2009
, pp. 221-224
-
-
Handley, C.A.1
Lambourn, B.D.2
-
6
-
-
77649189583
-
Surface Defects and their Role in the Shock Sensitivity of Cyclotrimethylene-Trinitramine
-
Bellitto, V. J.; Melnik, M. I. Surface Defects and their Role in the Shock Sensitivity of Cyclotrimethylene-Trinitramine Appl. Surf. Sci. 2010, 256, 3478-3481
-
(2010)
Appl. Surf. Sci.
, vol.256
, pp. 3478-3481
-
-
Bellitto, V.J.1
Melnik, M.I.2
-
7
-
-
80053123526
-
On the Shock Sensitivity of Explosive Compounds with Small-Scale Gap Test
-
Tan, B.; Long, X.; Peng, R.; Li, H.; Jin, B.; Chu, S. On the Shock Sensitivity of Explosive Compounds With Small-Scale Gap Test J. Phys. Chem. A 2011, 115, 10610-10616
-
(2011)
J. Phys. Chem. A
, vol.115
, pp. 10610-10616
-
-
Tan, B.1
Long, X.2
Peng, R.3
Li, H.4
Jin, B.5
Chu, S.6
-
8
-
-
0011113160
-
Sensitivity Relationships in Energetic Materials
-
In; NATO ASI Series C; Kluwer: Dordrecht, The Netherlands, Vol.
-
Storm, C. B.;; Stine, J. R.;; Kramer, J. F. Sensitivity Relationships in Energetic Materials. In Chemistry and Physics of Energetic Materials; Bulusu, S. N., Ed.; NATO ASI Series C; Kluwer: Dordrecht, The Netherlands, 1990; Vol. 309, pp 605-639.
-
(1990)
Chemistry and Physics of Energetic Materials
, vol.309
, pp. 605-639
-
-
Storm, C.B.1
Stine, J.R.2
Kramer, J.F.3
Bulusu, S.N.4
-
9
-
-
33749861826
-
Theoretical chemical characterization of energetic materials
-
DOI 10.1557/jmr.2006.0329
-
Rice, B. M.; Byrd, E. F. C. Theoretical Chemical Characterization of Energetic Materials J. Mater. Res. 2006, 21, 2444-2452 (Pubitemid 44560184)
-
(2006)
Journal of Materials Research
, vol.21
, Issue.10
, pp. 2444-2452
-
-
Rice, B.M.1
Byrd, E.F.C.2
-
10
-
-
34250320173
-
-
Structure and Bonding; Springer-Verlag: Heidelberg, Germany, Vol.
-
Zeman, S. High Energy Density Materials; Structure and Bonding; Springer-Verlag: Heidelberg, Germany, 2007; Vol. 125; pp 195-271.
-
(2007)
High Energy Density Materials
, vol.125
, pp. 195-271
-
-
Zeman, S.1
-
11
-
-
47849129022
-
REACH, a New Approach to Chemicals Regulation in Europe: A Brief History, Key Features, and Expected Outcomes
-
Warhurst, M. A. REACH, a New Approach to Chemicals Regulation in Europe: a Brief History, Key Features, and Expected Outcomes J. Eur. Environ. Planning Law 2005, 2, 164-172
-
(2005)
J. Eur. Environ. Planning Law
, vol.2
, pp. 164-172
-
-
Warhurst, M.A.1
-
12
-
-
0042427408
-
Development of a globally harmonized system for hazard communication
-
DOI 10.1078/1438-4639-00241
-
Silk, J. C. Development of a Globally Harmonized System for Hazard Communication Int. J. Hyg. Environ. Health 2003, 206, 447-452 (Pubitemid 37040014)
-
(2003)
International Journal of Hygiene and Environmental Health
, vol.206
, Issue.4-5
, pp. 447-452
-
-
Silk, J.C.1
-
15
-
-
0018454474
-
The Relationship of Impact Sensitivity with Structure of Organic High Explosives
-
Kamlet, M. J.; Adolph, H. G. The Relationship of Impact Sensitivity with Structure of Organic High Explosives. II. Polynitroaromatic Explosives Propellants, Explos., Pyrotech. 1979, 4, 30-34 (Pubitemid 9445680)
-
(1979)
Propellants Explos
, vol.4
, Issue.2
, pp. 30-34
-
-
Kamlet, M.J.1
Adolph, H.G.2
-
17
-
-
77952290432
-
First-Principles Band Gap Criterion for Impact Sensitivity of Energetic Crystals: A Review
-
Zhu, W.; Xiao, H. First-Principles Band Gap Criterion for Impact Sensitivity of Energetic Crystals: a Review Struct. Chem. 2010, 21, 657-665
-
(2010)
Struct. Chem.
, vol.21
, pp. 657-665
-
-
Zhu, W.1
Xiao, H.2
-
18
-
-
33751500147
-
Correlation of Impact Sensitivity with Electronic Levels and Structure of Molecules
-
Sharma, J.; Beard, B. C.; Chaykovsky, M. Correlation of Impact Sensitivity With Electronic Levels and Structure of Molecules J. Phys. Chem. 1991, 95, 1209-1213
-
(1991)
J. Phys. Chem.
, vol.95
, pp. 1209-1213
-
-
Sharma, J.1
Beard, B.C.2
Chaykovsky, M.3
-
19
-
-
3142732372
-
-
In; Politzer, P. Murray, J. S. Elsevier: Amsterdam, The Netherlands, Vol.
-
Zeman, S. In Energetic Materials; Politzer, P.; Murray, J. S., Eds.; Elsevier: Amsterdam, The Netherlands, 2003; Vol. 2; pp 25-52.
-
(2003)
Energetic Materials
, vol.2
, pp. 25-52
-
-
Zeman, S.1
-
20
-
-
0023330666
-
Relationship between Impact Sensitivity and Molecular Electronegativity
-
Mullay, J. A Relationship Between Impact Sensitivity and Molecular Electronegativity Propellants, Explos., Pyrotech. 1987, 12, 60-63
-
(1987)
Propellants, Explos., Pyrotech.
, vol.12
, pp. 60-63
-
-
Mullay, J.A.1
-
21
-
-
0002232701
-
Shock-Sensitivity Relationships for Nitramines and Nitroaliphatics
-
Politzer, P.; Murray, J. S.; Lane, P.; Sjoberg, P.; Adolph, H. G. Shock-Sensitivity Relationships for Nitramines and Nitroaliphatics Chem. Phys. Lett. 1991, 181, 78-82
-
(1991)
Chem. Phys. Lett.
, vol.181
, pp. 78-82
-
-
Politzer, P.1
Murray, J.S.2
Lane, P.3
Sjoberg, P.4
Adolph, H.G.5
-
22
-
-
54849427895
-
Initiation of Solid Explosives by Mechanical Impact
-
Pepekin, V. I.; Korsunskii, B. L.; Denisaev, A. A. Initiation of Solid Explosives by Mechanical Impact Combust., Explos. Shock Waves 2008, 44, 586-590
-
(2008)
Combust., Explos. Shock Waves
, vol.44
, pp. 586-590
-
-
Pepekin, V.I.1
Korsunskii, B.L.2
Denisaev, A.A.3
-
23
-
-
25444511522
-
Acid-Base Interactions in Energetic Materials: I. The Hard and Soft Acids and Bases (HSAB) Principle - Insights to Reactivity and Sensitivity of Energetic Materials
-
Koch, E. C. Acid-Base Interactions in Energetic Materials: I. The Hard and Soft Acids and Bases (HSAB) Principle-Insights to Reactivity and Sensitivity of Energetic Materials Propellants, Explos., Pyrotech. 2005, 30, 5-16
-
(2005)
Propellants, Explos., Pyrotech.
, vol.30
, pp. 5-16
-
-
Koch, E.C.1
-
24
-
-
0001126805
-
Thermal Decomposition of Energetic Materials. 61. Perfidy in the Amino-2,4,6-Trinitribenzene Series of Explosives
-
Brill, T. B.; James, K. J. Thermal Decomposition of Energetic Materials. 61. Perfidy in the Amino-2,4,6-Trinitribenzene Series of Explosives J. Phys. Chem. 1993, 97, 8752-8758
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 8752-8758
-
-
Brill, T.B.1
James, K.J.2
-
25
-
-
0000455949
-
Kinetics and Mechanisms of Thermal Decomposition of Nitroaromatic Explosives
-
Brill, T. B.; James, K. J. Kinetics and Mechanisms of Thermal Decomposition of Nitroaromatic Explosives Chem. Rev. 1993, 93, 2667-2692
-
(1993)
Chem. Rev.
, vol.93
, pp. 2667-2692
-
-
Brill, T.B.1
James, K.J.2
-
26
-
-
0037035164
-
A quantum mechanical investigation of the relation between impact sensitivity and the charge distribution in energetic molecules
-
DOI 10.1021/jp012602q
-
Rice, B. M.; Hare, J. J. A Quantum Mechanical Investigation of the Relation between Impact Sensitivity and the Charge Distribution in Energetic Molecules J. Phys. Chem. A 2002, 106, 1770-1783 (Pubitemid 35264227)
-
(2002)
Journal of Physical Chemistry A
, vol.106
, Issue.9
, pp. 1770-1783
-
-
Rice, B.M.1
Hare, J.J.2
-
27
-
-
56149091282
-
Review of the Establisment of Nitro Group Charge Method and Its Application
-
Zhang, C. Review of the Establisment of Nitro Group Charge Method and Its Application J. Hazard. Mater. 2009, 161, 21-28
-
(2009)
J. Hazard. Mater.
, vol.161
, pp. 21-28
-
-
Zhang, C.1
-
29
-
-
0542415700
-
Relationships between Impact Sensitivities and Molecular-Surface Electrostatic Potentials of Nitroaromatic and Nitroheterocyclic Molecules
-
Murray, J. S.; Lane, P.; Politzer, P. Relationships Between Impact Sensitivities and Molecular-Surface Electrostatic Potentials of Nitroaromatic and Nitroheterocyclic Molecules Mol. Phys. 1995, 85, 1-8
-
(1995)
Mol. Phys.
, vol.85
, pp. 1-8
-
-
Murray, J.S.1
Lane, P.2
Politzer, P.3
-
31
-
-
0028384749
-
A Relationship between the Impact Sensitivity and the Electronic Structures for the Unique N-N Bond in the HMX Polymorphs
-
Kohno, Y.; Maekawa, K.; Tsuchioka, T.; Hashizume, T.; Imamura, A. A Relationship between the Impact Sensitivity and the Electronic Structures for the Unique N-N Bond in the HMX Polymorphs Combust. Flame 1994, 96, 343-350
-
(1994)
Combust. Flame
, vol.96
, pp. 343-350
-
-
Kohno, Y.1
Maekawa, K.2
Tsuchioka, T.3
Hashizume, T.4
Imamura, A.5
-
32
-
-
13844312126
-
Molecular dynamics simulations of initial decomposition process on the unique N-N bond in nitramines in the crystalline state
-
Kohno, Y.; Ueda, K.; Imamura, A. Molecular Dynamics Simulations of Initial Decomposition Process on the Unique N-N Bond in Nitramines in the Crystalline State J. Phys. Chem. 1996, 100, 4701-4712 (Pubitemid 126790539)
-
(1996)
Journal of Physical Chemistry
, vol.100
, Issue.12
, pp. 4701-4712
-
-
Kohno, Y.1
Ueda, K.2
Imamura, A.3
-
33
-
-
77950810877
-
Simple Relationship for Predicting Impact Sensitivity of Nitroaromatics, Nitramines, and Nitroaliphatics
-
Keshavarz, M. H. Simple Relationship for Predicting Impact Sensitivity of Nitroaromatics, Nitramines, and Nitroaliphatics Propellants, Explos., Pyrotech. 2010, 35, 175-181
-
(2010)
Propellants, Explos., Pyrotech.
, vol.35
, pp. 175-181
-
-
Keshavarz, M.H.1
-
34
-
-
77951488342
-
New Correlations for Predicting Impact Sensitivities of Nitro Energetic Compounds
-
Lai, W.-P.; Lian, P.; Wang, B.-Z.; Ge, Z.-X. New Correlations for Predicting Impact Sensitivities of Nitro Energetic Compounds J. Energ. Mater. 2010, 28, 45-76
-
(2010)
J. Energ. Mater.
, vol.28
, pp. 45-76
-
-
Lai, W.-P.1
Lian, P.2
Wang, B.-Z.3
Ge, Z.-X.4
-
35
-
-
0041171382
-
Prediction of the impact sensitivity by neural networks
-
Nefati, H.; Cense, J.-M.; Legendre, J.-J. Prediction of the Impact Sensitivity by Neural Networks J. Chem. Inf. Comput. Sci. 1996, 36, 804-810 (Pubitemid 126581732)
-
(1996)
Journal of Chemical Information and Computer Sciences
, vol.36
, Issue.4
, pp. 804-810
-
-
Nefati, H.1
Cense, J.-M.2
Legendre, J.-J.3
-
36
-
-
16444381420
-
Optimization of neural networks architecture for impact sensitivity of energetic molecules
-
Cho, S. G.; No, K. T.; Goh, E. M.; Kim, J. K.; Shin, J. H.; Joo, Y. D.; Seong, S. Optimization of Neural Networks Architecture for Impact Sensitivity of Energetic Molecules Bull. Korean Chem. Soc. 2005, 26, 399-408 (Pubitemid 40477332)
-
(2005)
Bulletin of the Korean Chemical Society
, vol.26
, Issue.3
, pp. 399-408
-
-
Cho, S.G.1
No, K.T.2
Goh, E.M.3
Kim, J.K.4
Shin, J.H.5
Joo, Y.D.6
Seong, S.7
-
37
-
-
33745781474
-
Investigation of the various structure parameters for predicting impact sensitivity of energetic molecules via artificial neural network
-
DOI 10.1002/prep.200600030
-
Keshavarz, M. H.; Jaafari, M. Investigation of the Various Structure Parameters for Predicting Impact Sensitivity of Energetic Molecules via Artificial Neural Networks Propellants, Explos., Pyrotech. 2006, 31, 216-225 (Pubitemid 44022690)
-
(2006)
Propellants, Explosives, Pyrotechnics
, vol.31
, Issue.3
, pp. 216-225
-
-
Keshavarz, M.H.1
Jaafari, M.2
-
38
-
-
33845349264
-
Neural networks study on the correlation between impact sensitivity and molecular structures for nitramine explosives
-
DOI 10.1007/s11224-006-9101-6
-
Jun, Z.; Xin-Iu, C.; Bi, H.; Xiang-Dong, Y. Neural Networks Study on the Correlation Between Impact Sensitivity and Molecular Structures for Nitramine Explosives Struct. Chem. 2006, 17, 501-507 (Pubitemid 44876314)
-
(2006)
Structural Chemistry
, vol.17
, Issue.5
, pp. 501-507
-
-
Jun, Z.1
Xin-Lu, C.2
Bi, H.3
Xiang-Dong, Y.4
-
39
-
-
53649102808
-
Development of Quantitative Structure-Property Relationships for Predictive Modeling and Design of Energetic Materials
-
Morill, J. A.; Byrd, E. F. C. Development of Quantitative Structure-Property Relationships for Predictive Modeling and Design of Energetic Materials J. Mol. Graphics Model. 2008, 27, 349-355
-
(2008)
J. Mol. Graphics Model.
, vol.27
, pp. 349-355
-
-
Morill, J.A.1
Byrd, E.F.C.2
-
40
-
-
67349117399
-
Prediction of Impact Sensitivity of Nitro Energetic Compounds by Neural Network based on Electrotopological-State Indices
-
Wang, R.; Jiang, J.; Pan, Y.; Cao, H.; Cui, Y. Prediction of Impact Sensitivity of Nitro Energetic Compounds by Neural Network based on Electrotopological-State Indices J. Hazard. Mater. 2009, 166, 155-186
-
(2009)
J. Hazard. Mater.
, vol.166
, pp. 155-186
-
-
Wang, R.1
Jiang, J.2
Pan, Y.3
Cao, H.4
Cui, Y.5
-
41
-
-
84859511889
-
QSPR Studies of Impact Sensitivity of Nitro Energetic Compounds Using Three-Dimensional Descriptors
-
Xu, J.; Zhu, L.; Fang, D.; Wang, L.; Xiao, S.; Liu, L.; Xu, W. QSPR Studies of Impact Sensitivity of Nitro Energetic Compounds Using Three-Dimensional Descriptors J. Mol. Graphics Model. 2012, 36, 10-19
-
(2012)
J. Mol. Graphics Model.
, vol.36
, pp. 10-19
-
-
Xu, J.1
Zhu, L.2
Fang, D.3
Wang, L.4
Xiao, S.5
Liu, L.6
Xu, W.7
-
44
-
-
1942489142
-
Predictions for Weak Mechanical Ignition of Strain Hardened Granular Explosive
-
Gonthier, K. A. Predictions for Weak Mechanical Ignition of Strain Hardened Granular Explosive J. Appl. Phys. 2004, 95, 3482-3494
-
(2004)
J. Appl. Phys.
, vol.95
, pp. 3482-3494
-
-
Gonthier, K.A.1
-
45
-
-
33845290276
-
Ignition and detonation of solid explosives: A micromechanical burn model
-
DOI 10.1007/s00193-006-0038-x
-
Hamate, Y.; Horie, Y. Ignition and Detonation of Solid Explosives: a Micromechanical Burn Model Shock Waves 2006, 16, 125-147 (Pubitemid 44878239)
-
(2006)
Shock Waves
, vol.16
, Issue.2
, pp. 125-147
-
-
Hamate, Y.1
Horie, Y.2
-
46
-
-
0018057016
-
Relation between Shock Sensitiveness of Secondary Explosives and their Molecular Electronic Structure. 1. Nitroaromatics and Nitramines
-
Delpuech, A.; Cherville, J. Relation between Shock Sensitiveness of Secondary Explosives and their Molecular Electronic Structure. 1. Nitroaromatics and Nitramines Propellants, Explos., Pyrotech. 1978, 3, 169
-
(1978)
Propellants, Explos., Pyrotech.
, vol.3
, pp. 169
-
-
Delpuech, A.1
Cherville, J.2
-
47
-
-
0018678428
-
Relation between Shock Sensitiveness of Secondary Explosives and their Molecular Electronic Structure. 2. Nitrate Esters
-
Delpuech, A.; Cherville, J. Relation between Shock Sensitiveness of Secondary Explosives and their Molecular Electronic Structure. 2. Nitrate Esters Propellants, Explos., Pyrotech.. 1979, 4, 121
-
(1979)
Propellants, Explos., Pyrotech.
, vol.4
, pp. 121
-
-
Delpuech, A.1
Cherville, J.2
-
48
-
-
0346106423
-
Molecular Dynamics Simulation of Shockwaves Including some Nonadiabatic Effects
-
Mathieu, D.; Martin, P. Molecular Dynamics Simulation of Shockwaves Including some Nonadiabatic Effects Comput. Mater. Sci. 2000, 17, 347-351
-
(2000)
Comput. Mater. Sci.
, vol.17
, pp. 347-351
-
-
Mathieu, D.1
Martin, P.2
-
49
-
-
0000909296
-
An Excitonic Mechanism of Detonation Initiation in Explosives
-
Kuklja, M. M. An Excitonic Mechanism of Detonation Initiation in Explosives J. Chem. Phys. 2000, 112, 3417-3423
-
(2000)
J. Chem. Phys.
, vol.112
, pp. 3417-3423
-
-
Kuklja, M.M.1
-
50
-
-
0035310070
-
Role of electronic excitations in explosive decomposition of solids
-
DOI 10.1063/1.1350631
-
Kuklja, M. M.; Aduev, B. P.; Aluker, E. D.; Krasheninin, V. I.; Krechetov, A. G.; Mitrofanov, A. Y. Role of Electronic Excitations in Explosive Decomposition of Solids J. Appl. Phys. 2001, 89, 4156-4166 (Pubitemid 33732530)
-
(2001)
Journal of Applied Physics
, vol.89
, Issue.7
, pp. 4156-4166
-
-
Kuklja, M.M.1
Aduev, B.P.2
Aluker, E.D.3
Krasheninin, V.I.4
Krechetov, A.G.5
Mitrofanov, A.Yu.6
-
51
-
-
33845290820
-
Simulation of the electron dynamics in shockwaves and implications for the sensitivity of energetic materials
-
DOI 10.1238/Physica.Topical.118a00171, 1st International Meeting on Applied Physics, APHYS-2003
-
Mathieu, D.; Martin, P.; La Hargue, J.-P. Simulation of the Electron Dynamics in Shockwaves and Implications for the Sensitivity of Energetic Materials Phys. Scr., T 2005, 118, 171-173 (Pubitemid 351546796)
-
(2005)
Physica Scripta T
, vol.T118
, pp. 171-173
-
-
Mathieu, D.1
Martin, P.2
La Hargue, J.-P.3
-
52
-
-
84856342539
-
Electron-Ion Coupling in Shocked Energetic Materials
-
Reed, E. J. Electron-Ion Coupling in Shocked Energetic Materials J. Phys. Chem. C 2012, 116, 2205-2211
-
(2012)
J. Phys. Chem. C
, vol.116
, pp. 2205-2211
-
-
Reed, E.J.1
-
53
-
-
33845984195
-
Physical Origin of Hot Spots in Pressed Explosive Compositions
-
Belmas, R.; Plotard, J.-P. Physical Origin of Hot Spots in Pressed Explosive Compositions J. Phys. IV 1995, 5, 61-87
-
(1995)
J. Phys. IV
, vol.5
, pp. 61-87
-
-
Belmas, R.1
Plotard, J.-P.2
-
54
-
-
0037207419
-
Atomistic Mechanism for Hot Spot Initiation
-
Holian, B. L.; Germann, T. C.; Maillet, J.-B.; White, C. T. Atomistic Mechanism for Hot Spot Initiation Phys. Rev. Lett. 2002, 89, 285501
-
(2002)
Phys. Rev. Lett.
, vol.89
, pp. 285501
-
-
Holian, B.L.1
Germann, T.C.2
Maillet, J.-B.3
White, C.T.4
-
55
-
-
17744417673
-
Atomistic Mechanism for Hot Spot Initiation: Erratum
-
Holian, B. L.; Germann, T. C.; Maillet, J.-B.; White, C. T. Atomistic Mechanism for Hot Spot Initiation: Erratum Phys. Rev. Lett. 2003, 90, 069902
-
(2003)
Phys. Rev. Lett.
, vol.90
, pp. 069902
-
-
Holian, B.L.1
Germann, T.C.2
Maillet, J.-B.3
White, C.T.4
-
56
-
-
2142694409
-
Theoretical Investigation of the High-Pressure Behavior of Nitric Acid
-
Méreau, R.; Mathieu, D.; Elstner, M.; Frauenheim, T. Theoretical Investigation of the High-Pressure Behavior of Nitric Acid Phys. Rev. B 2004, 69, 104101
-
(2004)
Phys. Rev. B
, vol.69
, pp. 104101
-
-
Méreau, R.1
Mathieu, D.2
Elstner, M.3
Frauenheim, T.4
-
57
-
-
18844388945
-
Energy of Charged States in the RDX Crystal: Trapping of Charge-Transfer Pairs As a Possible Mechanism for Initiating Detonation
-
Tsiaouris, D.; Munn, R. W. Energy of Charged States in the RDX Crystal: Trapping of Charge-Transfer Pairs As a Possible Mechanism for Initiating Detonation J. Chem. Phys. 2005, 122, 184708
-
(2005)
J. Chem. Phys.
, vol.122
, pp. 184708
-
-
Tsiaouris, D.1
Munn, R.W.2
-
58
-
-
33745804985
-
Mesoscopic approach to energetic material sensitivity
-
DOI 10.1080/07370650500374342, PII L827M24853753040
-
Ramaswamy, A. L. Mesoscopic Approach to Energetic Material Sensitivity J. Energ. Mater. 2006, 24, 35-65 (Pubitemid 44017617)
-
(2006)
Journal of Energetic Materials
, vol.24
, Issue.1
, pp. 35-65
-
-
Ramaswamy, A.L.1
-
59
-
-
0042581983
-
Shocked Molecular Solids: Vibrational Up Pumping, Defect Hot Spot Formation, and the Onset of Chemistry
-
Dlott, D. D.; Fayer, M. D. Shocked Molecular Solids: Vibrational Up Pumping, Defect Hot Spot Formation, and the Onset of Chemistry J. Chem. Phys. 1990, 92, 3798-3811
-
(1990)
J. Chem. Phys.
, vol.92
, pp. 3798-3811
-
-
Dlott, D.D.1
Fayer, M.D.2
-
60
-
-
0005687076
-
Chemical Reaction Initiation and Hot-Spot Formation in Shocked Energetic Molecular Materials
-
Tokmakoff, A.; Fayer, M. D.; Dlott, D. D. Chemical Reaction Initiation and Hot-Spot Formation in Shocked Energetic Molecular Materials J. Phys. Chem. 1993, 97, 1901-1913
-
(1993)
J. Phys. Chem.
, vol.97
, pp. 1901-1913
-
-
Tokmakoff, A.1
Fayer, M.D.2
Dlott, D.D.3
-
61
-
-
0028515355
-
Energy Tranfer Rates in Primary, Secondary, and Insensitive Explosives
-
Fried, L. E.; Ruggiero, A. J. Energy Tranfer Rates in Primary, Secondary, and Insensitive Explosives J. Phys. Chem. 1994, 98, 9786-9791
-
(1994)
J. Phys. Chem.
, vol.98
, pp. 9786-9791
-
-
Fried, L.E.1
Ruggiero, A.J.2
-
62
-
-
0000092677
-
Spectroscopic determination of impact sensitivities of explosives
-
McNesby, K. L.; Coffey, C. S. Spectroscopic Determination of Impact Sensitivities of Explosives J. Phys. Chem. B 1997, 101, 3097-3104 (Pubitemid 127581088)
-
(1997)
Journal of Physical Chemistry B
, vol.101
, Issue.16
, pp. 3097-3104
-
-
McNesby, K.L.1
Coffey, C.S.2
-
63
-
-
0037258525
-
Energy transfer rates and impact sensitivities of crystalline explosives
-
DOI 10.1016/S0010-2180(02)00461-3
-
Ye, S.; Tonokura, K.; Koshi, M. Energy Transfer Rates and Impact Sensitivities of Crystalline Explosives Combust. Flame 2003, 132, 240-246 (Pubitemid 36164895)
-
(2003)
Combustion and Flame
, vol.132
, Issue.1-2
, pp. 240-246
-
-
Ye, S.1
Tonokura, K.2
Koshi, M.3
-
64
-
-
33749595382
-
Theoretical studies of energy transfer rates of secondary explosives
-
DOI 10.1021/jp0628151
-
Ye, S.; Koshi, M. Theoretical Studies of Energy Transfer Rates of Secondary Explosives J. Phys. Chem. B 2006, 110, 18515-18520 (Pubitemid 44547359)
-
(2006)
Journal of Physical Chemistry B
, vol.110
, Issue.37
, pp. 18515-18520
-
-
Ye, S.1
Koshi, M.2
-
65
-
-
34047264319
-
Correlation between Normal Mode Vibrations and Impact Sensitivities of Some Secondary Explosives
-
Su-Hong, G.; Xin-Lu, C.; Li-Sha, W.; Xiang-Dong, Y. Correlation Between Normal Mode Vibrations and Impact Sensitivities of Some Secondary Explosives J. Mol. Struct. 2007, 809, 55-60
-
(2007)
J. Mol. Struct.
, vol.809
, pp. 55-60
-
-
Su-Hong, G.1
Xin-Lu, C.2
Li-Sha, W.3
Xiang-Dong, Y.4
-
67
-
-
33748446412
-
Relationship between the Bond Dissociation Energies and Impact Sensitivities of Some Nitro-Explosives
-
Song, X.-S.; Cheng, X.-L.; Yang, X.-D.; He, B. Relationship between the Bond Dissociation Energies and Impact Sensitivities of Some Nitro-Explosives Propellants, Explos., Pyrotech. 2006, 31, 306-309
-
(2006)
Propellants, Explos., Pyrotech.
, vol.31
, pp. 306-309
-
-
Song, X.-S.1
Cheng, X.-L.2
Yang, X.-D.3
He, B.4
-
68
-
-
78650309369
-
Investigation of Correlation between Impact Sensitivities and Bond Dissociation Energies in some Triazole Energetic Compounds
-
Jun, Z.; Da-Hai, X.; Xin-Iu, C. Investigation of Correlation between Impact Sensitivities and Bond Dissociation Energies in some Triazole Energetic Compounds Struct. Chem. 2010, 21, 1235-1240
-
(2010)
Struct. Chem.
, vol.21
, pp. 1235-1240
-
-
Jun, Z.1
Da-Hai, X.2
Xin-Iu, C.3
-
69
-
-
80051768959
-
Topological Analysis of the Molecular Charge Density and Impact Sensitivity Models of Energetic Molecules
-
Anders, G.; Borges, I., Jr. Topological Analysis of the Molecular Charge Density and Impact Sensitivity Models of Energetic Molecules J. Phys. Chem. A 2011, 115, 9055-9068
-
(2011)
J. Phys. Chem. A
, vol.115
, pp. 9055-9068
-
-
Anders, G.1
Borges Jr., I.2
-
70
-
-
84857422238
-
Theoretical Shock Sensitivity Index for Explosives
-
Mathieu, D. Theoretical Shock Sensitivity Index for Explosives J. Phys. Chem. A 2012, 116, 1794-1800
-
(2012)
J. Phys. Chem. A
, vol.116
, pp. 1794-1800
-
-
Mathieu, D.1
-
71
-
-
33947651444
-
Chemistry of Detonations. I. A Simple Method for Calculating Detonation Properties of C-H-N-O Explosives
-
Kamlet, M. J.; Jacob, S. J. Chemistry of Detonations. I. A Simple Method for Calculating Detonation Properties of C-H-N-O Explosives J. Chem. Phys. 1968, 48, 23
-
(1968)
J. Chem. Phys.
, vol.48
, pp. 23
-
-
Kamlet, M.J.1
Jacob, S.J.2
-
72
-
-
33745597056
-
RM1: A reparameterization of AM1 for H, C, N, O, P, S, F, Cl, Br, and I
-
DOI 10.1002/jcc.20425
-
Rocha, G. B.; Freire, R. O.; Simas, A. M.; Stewart, J. J. P. RM1: a Reparameterization of AM1 for H, C, N, O, P, S, F, Cl, Br, and I J. Comput. Chem. 2006, 27, 1101-1111 (Pubitemid 43989803)
-
(2006)
Journal of Computational Chemistry
, vol.27
, Issue.10
, pp. 1101-1111
-
-
Rocha, G.B.1
Freire, R.O.2
Simas, A.M.3
Stewart, J.J.P.4
-
73
-
-
84875189253
-
-
(accessed Feb 8, 2013).
-
Mopac7. http://sourceforge.net/projects/mopac7 (accessed Feb 8, 2013).
-
Mopac7
-
-
-
74
-
-
79961028101
-
-
(accessed Feb 8).
-
NIST Chemistry WebBook. http://webbook.nist.gov/chemistry (accessed Feb 8, 2013).
-
(2013)
NIST Chemistry WebBook
-
-
-
76
-
-
0011083273
-
Harmonic vibrational frequencies: An evaluation of Hartree-Fock, Moller-Plesset, quadratic configuration interaction, density functional theory, and semiempirical scale factors
-
Scott, A. P.; Radom, L. Harmonic Vibrational Frequencies: An Evaluation of Hartree-Fock, Moller-Plesset, Quadratic Configuration Interaction, Density Functional Theory, and Semiempirical Scale Factors J. Phys. Chem. 1996, 100, 16502-16513 (Pubitemid 126787989)
-
(1996)
Journal of Physical Chemistry
, vol.100
, Issue.41
, pp. 16502-16513
-
-
Scott, A.P.1
Radom, L.2
-
77
-
-
26244461462
-
Balanced basis sets of split valence, triple zeta valence and quadruple zeta valence quality for H to Rn: Design and assessment of accuracy
-
DOI 10.1039/b508541a
-
Weigend, F.; Ahlrichs, R. Balanced Basis Sets of Split Valence, Triple Zeta Valence and Quadruple Zeta Valence Quality for H to Rn: Design and Assessment of Accuracy Phys. Chem. Chem. Phys. 2005, 7, 3297-3305 (Pubitemid 41412231)
-
(2005)
Physical Chemistry Chemical Physics
, vol.7
, Issue.18
, pp. 3297-3305
-
-
Weigend, F.1
Ahlrichs, R.2
-
78
-
-
59349105675
-
Efficient, Approximate and Parallel Hartree-Fock and Hybrid DFT calculations. A Chain of Spheres Algorithm for the Hartree-Fock Exchange
-
Neese, F.; Wennmohs, F.; Hansen, A.; Becker, U. Efficient, Approximate and Parallel Hartree-Fock and Hybrid DFT calculations. A Chain of Spheres Algorithm for the Hartree-Fock Exchange Chem. Phys. 2012, 356, 98-109
-
(2012)
Chem. Phys.
, vol.356
, pp. 98-109
-
-
Neese, F.1
Wennmohs, F.2
Hansen, A.3
Becker, U.4
-
79
-
-
4043164887
-
Accurate Description of van der Waals Complexes by Density Functional Theory Including Empirical Corrections
-
Grimme, S. Accurate Description of van der Waals Complexes by Density Functional Theory Including Empirical Corrections J. Comput. Chem. 2004, 25, 1463-1473
-
(2004)
J. Comput. Chem.
, vol.25
, pp. 1463-1473
-
-
Grimme, S.1
-
80
-
-
0003145333
-
Anisotropic Shock Sensitivity and Detonation Temperature of Pentaerythritol Tetranitrate Single Crystal
-
Yoo, C. S.; Holmes, N. C.; Souers, P. C.; Wu, C. J.; Ree, F. H.; Dick, J. J. Anisotropic Shock Sensitivity and Detonation Temperature of Pentaerythritol Tetranitrate Single Crystal J. Appl. Phys. 2000, 88, 70-75
-
(2000)
J. Appl. Phys.
, vol.88
, pp. 70-75
-
-
Yoo, C.S.1
Holmes, N.C.2
Souers, P.C.3
Wu, C.J.4
Ree, F.H.5
Dick, J.J.6
-
81
-
-
77749239671
-
Physical Mechanism of Anisotropic Sensitivity in Pentaerythritol Tetranitrate from Compressive-Shear Reaction Dynamics Simulations
-
Zybin, S. V.; Goddard, W. A., III; Xu, P.; van Duin, A. C. T.; Thompson, A. P. Physical Mechanism of Anisotropic Sensitivity in Pentaerythritol Tetranitrate from Compressive-Shear Reaction Dynamics Simulations Appl. Phys. Lett. 2010, 96, 081918
-
(2010)
Appl. Phys. Lett.
, vol.96
, pp. 081918
-
-
Zybin, S.V.1
Goddard III, W.A.2
Xu, P.3
Van Duin, A.C.T.4
Thompson, A.P.5
-
82
-
-
78651448112
-
Effects of Defects on Thermal Decomposition of HMX via ReaxFF Molecular Dynamics Simulations
-
Zhou, T.-T.; Huang, F.-L. Effects of Defects on Thermal Decomposition of HMX via ReaxFF Molecular Dynamics Simulations J. Phys. Chem. B 2011, 115, 278-287
-
(2011)
J. Phys. Chem. B
, vol.115
, pp. 278-287
-
-
Zhou, T.-T.1
Huang, F.-L.2
|