-
1
-
-
4644317279
-
Tetrazine explosives
-
Chavez, D. E., M. A. Hiskey, and D. L. Naud. 2004. Tetrazine explosives. Propellants, Explosives, Pyrotechnics, 29: 209-215.
-
(2004)
Propellants, Explosives, Pyrotechnics
, vol.29
, pp. 209-215
-
-
Chavez, D.E.1
Hiskey, M.A.2
Naud, D.L.3
-
2
-
-
77955096029
-
Quantum chemical studies on the condensed polynitrotriazoles
-
Ravi, P., G. M. Gore, S. P. Tewari, and A. K. Sikder. 2010. Quantum chemical studies on the condensed polynitrotriazoles. Journal of Molecular Structure (Theochem), 955: 171-177.
-
(2010)
Journal of Molecular Structure (Theochem)
, vol.955
, pp. 171-177
-
-
Ravi, P.1
Gore, G.M.2
Tewari, S.P.3
Sikder, A.K.4
-
3
-
-
77951628575
-
Selective preparation of 3,4,5-trinitro-1H-pyrazole: A stable all carbon nitrated arene
-
Herve, G., C. Rossel, and H. Graindrog. 2010. Selective preparation of 3,4,5-trinitro-1H-pyrazole: A stable all carbon nitrated arene. Angewandte Chemie International Edition, 49: 3177-3181.
-
(2010)
Angewandte Chemie International Edition
, vol.49
, pp. 3177-3181
-
-
Herve, G.1
Rossel, C.2
Graindrog, H.3
-
4
-
-
57649208404
-
Synthesis, and charaterization of a new class of energetic compounds-Ammonium nitriminotetrazolates
-
a) Klapötke T. M., H. A. Laub, and J. Stierstorfer. 2008. Synthesis, and charaterization of a new class of energetic compounds-Ammonium nitriminotetrazolates. Propellants, Explosives, Pyrotechnics, 33: 421-430; (b) Klapötke T.M. 2007. Struktur und Bindung. Berlin: Springer.
-
(2008)
Propellants, Explosives, Pyrotechnics
, vol.33
, pp. 421-430
-
-
Klapötke, T.M.1
Laub, H.A.2
Stierstorfer, J.3
Klapötke, T.M.4
-
6
-
-
84859613092
-
-
Crystal habit of LLM-105 (2,6-diamino-3,5-dinitropyrazine 1-oxide). 12th Symposium of New Trends in Research of Energetic Materials, April 1-3, 2009, Pardubice, Czech Republic
-
Bellamy, A. J., P. Golding, and M. F. Mahon. 2009. Crystal habit of LLM-105 (2,6-diamino-3,5-dinitropyrazine 1-oxide). 12th Symposium of New Trends in Research of Energetic Materials, April 1-3, 2009, Pardubice, Czech Republic.
-
(2009)
-
-
Bellamy, A.J.1
Golding, P.2
Mahon, M.F.3
-
7
-
-
3042628066
-
A review of advanced high performance, insensitive and thermally stable energetic materials emerging for military and space applications
-
Sikder, A. K. and N. Sikder. 2004. A review of advanced high performance, insensitive and thermally stable energetic materials emerging for military and space applications. Journal of Hazardous Materials A, 112: 1-15.
-
(2004)
Journal of Hazardous Materials A
, vol.112
, pp. 1-15
-
-
Sikder, A.K.1
Sikder, N.2
-
8
-
-
10744228105
-
Molecular design of analogues of 2,6-diamino-3,5-dinitropyrazine-1-oxide
-
He, W., G. Zhou, J. Li, and A. Tian. 2004. Molecular design of analogues of 2,6-diamino-3,5-dinitropyrazine-1-oxide. Journal of Molecular Structure (Theochem), 668: 201-208.
-
(2004)
Journal of Molecular Structure (Theochem)
, vol.668
, pp. 201-208
-
-
He, W.1
Zhou, G.2
Li, J.3
Tian, A.4
-
9
-
-
2542436000
-
Studies of novel heterocycles insensitive high explosive compounds: Pyridines, pyrazines and their bicyclic analogues
-
Millar, R. W., S. P. Philbin, R. P. Claride, and J. Hamid. 2004. Studies of novel heterocycles insensitive high explosive compounds: Pyridines, pyrazines and their bicyclic analogues. Propellants, Explosives, Pyrotechnics, 29: 81-92.
-
(2004)
Propellants, Explosives, Pyrotechnics
, vol.29
, pp. 81-92
-
-
Millar, R.W.1
Philbin, S.P.2
Claride, R.P.3
Hamid, J.4
-
10
-
-
77953163809
-
Kinetic stability and propellant performance of green energetic materials
-
Rahm, M. and T. Brinck. 2010. Kinetic stability and propellant performance of green energetic materials. Chemistry-A European Journal, 16: 6590-6600.
-
(2010)
Chemistry - A European Journal
, vol.16
, pp. 6590-6600
-
-
Rahm, M.1
Brinck, T.2
-
11
-
-
77953959621
-
Computational study on 2,6-diamino-3,5-dinitropyrazine and its 1-oxide and a,4-dioxide derivatives
-
Gökçinar, E., T. M. Klapötke, and A. J. Bellamy. 2010. Computational study on 2,6-diamino-3,5-dinitropyrazine and its 1-oxide and a,4-dioxide derivatives. Journal of Molecular Structure (Theochem), 953: 18-23.
-
(2010)
Journal of Molecular Structure (Theochem)
, vol.953
, pp. 18-23
-
-
Gökçinar, E.1
Klapötke, T.M.2
Bellamy, A.J.3
-
14
-
-
61449091843
-
Theoretical treatment of some novel nitropyrimidines
-
In: Warey P. B., editors Nova Publishers
-
Türker, L., S. Gümüş, T. Atalar, and Y. Çamur. 2007. Theoretical treatment of some novel nitropyrimidines. In New Research on Hazardous Materials, P. B. Warey, ed. New York: Nova Publishers.
-
(2007)
New Research on Hazardous Materials
-
-
Türker, L.1
Gümüş, S.2
Atalar, T.3
Çamur, Y.4
-
15
-
-
0038626673
-
-
Gaussian Inc
-
Frisch, M. J., G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, J. A. Montgomery Jr., T. Vreven, K. N. Kudin, J. C. Burant, J. M. Millam, S. S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G. A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J. E. Knox, H. P. Hratchian, J. B. Cross, C. Adamo, J. Jaramillo, R. Gomperts, R. E. Stratmann, O. Yazyev, A. J. Austin, R. Cammi, C. Pomelli, J. W. Ochterski, P. Y. Ayala, K. Morokuma, G. A. Voth, P. Salvador, J. J. Dannenberg, V. G. Zakrzewski, S. Dapprich, A. D. Daniels, M. C. Strain, O. Farkas, D. K. Malick, A. D. Rabuck, K. Raghavachari, J. B. Foresman, J. V. Ortiz, Q. Cui, A. G. Baboul, S. Clifford, J. Cioslowski, B. B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. L. Martin, D. J. Fox, T. Keith, M. A. Al-Laham, C. Y. Peng, A. Nanayakkara, M. Challacombe, P. M. W. Gill, B. Johnson, W. Chen, M. W. Wong, C. Gonzalez, and J. A. Pople. 2004. Gaussian 03. Revision D.01. Wallingford, CT: Gaussian Inc.
-
(2004)
Gaussian 03
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Montgomery Jr, J.A.7
Vreven, T.8
Kudin, K.N.9
Burant, J.C.10
Millam, J.M.11
Iyengar, S.S.12
Tomasi, J.13
Barone, V.14
Mennucci, B.15
Cossi, M.16
Scalmani, G.17
Rega, N.18
Petersson, G.A.19
Nakatsuji, H.20
Hada, M.21
Ehara, M.22
Toyota, K.23
Fukuda, R.24
Hasegawa, J.25
Ishida, M.26
Nakajima, T.27
Honda, Y.28
Kitao, O.29
Nakai, H.30
Klene, M.31
Li, X.32
Knox, J.E.33
Hratchian, H.P.34
Cross, J.B.35
Adamo, C.36
Jaramillo, J.37
Gomperts, R.38
Stratmann, R.E.39
Yazyev, O.40
Austin, A.J.41
Cammi, R.42
Pomelli, C.43
Ochterski, J.W.44
Ayala, P.Y.45
Morokuma, K.46
Voth, G.A.47
Salvador, P.48
Dannenberg, J.J.49
Zakrzewski, V.G.50
Dapprich, S.51
Daniels, A.D.52
Strain, M.C.53
Farkas, O.54
Malick, D.K.55
Rabuck, A.D.56
Raghavachari, K.57
Foresman, J.B.58
Ortiz, J.V.59
Cui, Q.60
Baboul, A.G.61
Clifford, S.62
Cioslowski, J.63
Stefanov, B.B.64
Liu, G.65
Liashenko, A.66
Piskorz, P.67
Komaromi, I.68
Martin, R.L.69
Fox, D.J.70
Keith, T.71
Al-Laham, M.A.72
Peng, C.Y.73
Nanayakkara, A.74
Challacombe, M.75
Gill, P.M.W.76
Johnson, B.77
Chen, W.78
Wong, M.W.79
Gonzalez, C.80
Pople, J.A.81
more..
-
16
-
-
0042113153
-
Self-consistent equations including exchange and correlation effects
-
Kohn, W. and L. J. Sham. 1965. Self-consistent equations including exchange and correlation effects. Physical Review, 140: 1133-1138.
-
(1965)
Physical Review
, vol.140
, pp. 1133-1138
-
-
Kohn, W.1
Sham, L.J.2
-
18
-
-
4243553426
-
Density-functional exchange-Energy approximation with correct asymptotic behavior
-
Becke, A. D. 1988. Density-functional exchange-Energy approximation with correct asymptotic behavior. Physical Review A, 38: 3098-3100.
-
(1988)
Physical Review A
, vol.38
, pp. 3098-3100
-
-
Becke, A.D.1
-
19
-
-
0000216001
-
Accurate spin-dependent electron liquid correlation energies for local spin density calculations: A critical analysis
-
Vosko, S. H., L. Vilk, and M. Nusair. 1980. Accurate spin-dependent electron liquid correlation energies for local spin density calculations: A critical analysis. Canadian Journal of Physics, 58: 1200-1211.
-
(1980)
Canadian Journal of Physics
, vol.58
, pp. 1200-1211
-
-
Vosko, S.H.1
Vilk, L.2
Nusair, M.3
-
20
-
-
0345491105
-
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density
-
Lee, C., W. Yang, and R. G. Parr. 1988. Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density. Physical Review B, 37: 785-789.
-
(1988)
Physical Review B
, vol.37
, pp. 785-789
-
-
Lee, C.1
Yang, W.2
Parr, R.G.3
-
21
-
-
0038596731
-
Results obtained with the correlation-energy density functionals of Becke and Lee, Yang and Parr
-
Miehlich, B., A. Savin, H. Stoll, and H. Preuss. 1989. Results obtained with the correlation-energy density functionals of Becke and Lee, Yang and Parr. Chemical Physics Letters, 157: 200-206.
-
(1989)
Chemical Physics Letters
, vol.157
, pp. 200-206
-
-
Miehlich, B.1
Savin, A.2
Stoll, H.3
Preuss, H.4
-
23
-
-
28944451045
-
Density functional calculations of bond dissociation energies for removal of the nitrogen dioxide moiety in some nitroaromatic molecules
-
Shao, J., X. Cheng, and X. Yang. 2005. Density functional calculations of bond dissociation energies for removal of the nitrogen dioxide moiety in some nitroaromatic molecules. Journal of Molecular Structure (Theochem), 755: 127-130.
-
(2005)
Journal of Molecular Structure (Theochem)
, vol.755
, pp. 127-130
-
-
Shao, J.1
Cheng, X.2
Yang, X.3
-
24
-
-
84890021933
-
The calculation of small molecular interaction by the differences of separate total energies: Some procedures with reduced errors
-
Boys, S. F. and F. Bernardi. 1970. The calculation of small molecular interaction by the differences of separate total energies: Some procedures with reduced errors. Molecular Physics, 19: 553-566.
-
(1970)
Molecular Physics
, vol.19
, pp. 553-566
-
-
Boys, S.F.1
Bernardi, F.2
-
25
-
-
0003490993
-
-
In: Tossel J. A., editors Kluwer
-
Pulay, P., J. F. Hinton, and K. Wolinski. 1993. In Nuclear Magnetic Shieldings and Molecular Structure, NATOASI Series C, vol. 386, edited by J. A. Tossel. Dordrecht, The Netherlands: Kluwer.
-
(1993)
Nuclear Magnetic Shieldings and Molecular Structure, NATOASI Series C
, vol.386
-
-
Pulay, P.1
Hinton, J.F.2
Wolinski, K.3
-
26
-
-
77956446427
-
2 (X=C,N,O) and Mulliken charges of nitro group
-
2 (X=C,N,O) and Mulliken charges of nitro group. Journal of Hazardous Materials A, 183: 908.
-
(2010)
Journal of Hazardous Materials A
, vol.183
, pp. 908
-
-
Tan, B.1
Long, X.2
Peng, R.3
Li, H.4
Jin, B.5
Chu, S.6
Dong, H.7
-
27
-
-
33751347818
-
Molecular structure aspects of initation of some highly thermostable polynitro arenes
-
Zeman, S., Z. Friedl, and M. Rohac. 2006. Molecular structure aspects of initation of some highly thermostable polynitro arenes. Thermochimica Acta, 451: 105-114.
-
(2006)
Thermochimica Acta
, vol.451
, pp. 105-114
-
-
Zeman, S.1
Friedl, Z.2
Rohac, M.3
-
28
-
-
19944421798
-
Investigation of correlation between impact sensitivities and nitro group charges in nitro compounds
-
Zhang, C., Y. Shu, Y. Huang, X. Zhao, and H. Dong. 2005. Investigation of correlation between impact sensitivities and nitro group charges in nitro compounds. Journal of Physical Chemistry B, 109: 8978-8982.
-
(2005)
Journal of Physical Chemistry B
, vol.109
, pp. 8978-8982
-
-
Zhang, C.1
Shu, Y.2
Huang, Y.3
Zhao, X.4
Dong, H.5
-
30
-
-
9644266738
-
Explosive chemistry: Simulating the chemistry of energetic materials at extreme conditions
-
Manaa, M. R., L. E. Fried, and E. J. Reed. 2003. Explosive chemistry: Simulating the chemistry of energetic materials at extreme conditions. Journal of Computer-Aided Molecular Design, 10: 75-97.
-
(2003)
Journal of Computer-Aided Molecular Design
, vol.10
, pp. 75-97
-
-
Manaa, M.R.1
Fried, L.E.2
Reed, E.J.3
-
31
-
-
33751500147
-
Correlation of impact sensitivity with electronic levels and structure of molecules
-
Sharma, J., B. C. Beard, and M. Chaykovsky. 1991. Correlation of impact sensitivity with electronic levels and structure of molecules. Journal of Physical Chemistry, 95: 1209-1213.
-
(1991)
Journal of Physical Chemistry
, vol.95
, pp. 1209-1213
-
-
Sharma, J.1
Beard, B.C.2
Chaykovsky, M.3
-
32
-
-
67649743487
-
Tunneling effect and impact sensitivity of certain explosives
-
Türker, L. 2009. Tunneling effect and impact sensitivity of certain explosives. Journal of Hazardous Materials, 169: 819-823.
-
(2009)
Journal of Hazardous Materials
, vol.169
, pp. 819-823
-
-
Türker, L.1
-
33
-
-
67649823466
-
Contemplation on spark sensitivity of certain nitramine type explosives
-
Türker, L.2009. Contemplation on spark sensitivity of certain nitramine type explosives. Journal of Hazardous Materials, 169: 454-459.
-
(2009)
Journal of Hazardous Materials
, vol.169
, pp. 454-459
-
-
Türker, L.1
-
36
-
-
0000062558
-
Aromaticity today: Energetic and structural criteria
-
Glukhovtsev, M. N. 1997. Aromaticity today: Energetic and structural criteria. Journal of Chemical Education, 74: 132-136.
-
(1997)
Journal of Chemical Education
, vol.74
, pp. 132-136
-
-
Glukhovtsev, M.N.1
-
37
-
-
0343362681
-
Aromaticity: A theoretical concept of immense practical importance
-
Krygowski, T. M., M. K. Cyranski, Z. Czarnocki, G. Hafelinger, and A. R. Katritzky. 2000. Aromaticity: A theoretical concept of immense practical importance. Tetrahedron, 56: 1783-1796.
-
(2000)
Tetrahedron
, vol.56
, pp. 1783-1796
-
-
Krygowski, T.M.1
Cyranski, M.K.2
Czarnocki, Z.3
Hafelinger, G.4
Katritzky, A.R.5
-
38
-
-
0000630951
-
Introduction: Aromaticity
-
Schleyer, P. R. 2001. Introduction: Aromaticity. Chemical Reviews, 101: 1115-1118.
-
(2001)
Chemical Reviews
, vol.101
, pp. 1115-1118
-
-
Schleyer, P.R.1
-
39
-
-
0037154717
-
To what extent can aromaticity be defined uniquely?
-
Cyranski, M. K., T. M. Krygowski, A. R. Katritzky, and P. R. Schleyer. 2002. To what extent can aromaticity be defined uniquely? Journal of Organic Chemistry, 67: 1333-1338.
-
(2002)
Journal of Organic Chemistry
, vol.67
, pp. 1333-1338
-
-
Cyranski, M.K.1
Krygowski, T.M.2
Katritzky, A.R.3
Schleyer, P.R.4
-
40
-
-
0011190497
-
Nucleus independent chemical shifts: A simple and efficient aromaticity probe
-
Schleyer, P. R., C. Maerker, A. Dransfeld, H. Jiao, and N. J. R. E. Hommes. 1996. Nucleus independent chemical shifts: A simple and efficient aromaticity probe. Journal of the American Chemical Society, 118: 6317-6318.
-
(1996)
Journal of the American Chemical Society
, vol.118
, pp. 6317-6318
-
-
Schleyer, P.R.1
Maerker, C.2
Dransfeld, A.3
Jiao, H.4
Hommes, N.J.R.E.5
-
41
-
-
11644271412
-
Aromaticity of pericyclic reaction transition structures: Magnetic evidence
-
Jiao, H. and P. R. Schleyer. 1998. Aromaticity of pericyclic reaction transition structures: Magnetic evidence. Journal of Physical Organic Chemistry, 111: 655-662.
-
(1998)
Journal of Physical Organic Chemistry
, vol.111
, pp. 655-662
-
-
Jiao, H.1
Schleyer, P.R.2
-
43
-
-
0037127069
-
Quantification of aromaticity in oxocarbons: The problem of the fictitious "nonaromatic" reference system
-
Quinonero, D., C. Garau, A. Frontera, P. Ballester, A. Costa, and P. M. Deya. 2002. Quantification of aromaticity in oxocarbons: The problem of the fictitious "nonaromatic" reference system. Chemistry-A European Journal, 8: 433-438.
-
(2002)
Chemistry - A European Journal
, vol.8
, pp. 433-438
-
-
Quinonero, D.1
Garau, C.2
Frontera, A.3
Ballester, P.4
Costa, A.5
Deya, P.M.6
-
44
-
-
0003000232
-
Nucleus-independent chemical shifts from semiempirical calculations
-
Patchkovskii, S. and W. Thiel. 2000. Nucleus-independent chemical shifts from semiempirical calculations. Journal of Molecular Modeling, 6: 67-75.
-
(2000)
Journal of Molecular Modeling
, vol.6
, pp. 67-75
-
-
Patchkovskii, S.1
Thiel, W.2
-
45
-
-
78149411525
-
C-N bond dissociation energies: An assessment of contemporary DFT methodologies
-
Qi, C., Q. H. Lin, Y. Y. Li, S. P. Pang, and R. B. Zhang. 2010. C-N bond dissociation energies: An assessment of contemporary DFT methodologies. Journal of Molecular Structure (Theochem), 961: 97-100.
-
(2010)
Journal of Molecular Structure (Theochem)
, vol.961
, pp. 97-100
-
-
Qi, C.1
Lin, Q.H.2
Li, Y.Y.3
Pang, S.P.4
Zhang, R.B.5
-
46
-
-
0018678428
-
Relation entre La structure elekronique et la sensibile au choc des explosives secondaires niters. Critere moleculaire de sensibilite II. Cas des esters nitriques
-
Depluech, A. and J. Cherville. 1979. Relation entre La structure elekronique et la sensibile au choc des explosives secondaires niters. Critere moleculaire de sensibilite II. Cas des esters nitriques. Propellants, Explosives, Pyrotechnics, 4: 121-128.
-
(1979)
Propellants, Explosives, Pyrotechnics
, vol.4
, pp. 121-128
-
-
Depluech, A.1
Cherville, J.2
-
48
-
-
0018454474
-
The relationship of impact sensitivity with structure of organic high explosives II. Polynitroaromatic explosives
-
Kamlet, M. J. and H. G. Adolf. 1979. The relationship of impact sensitivity with structure of organic high explosives II. Polynitroaromatic explosives. Propellants, Explosives, Pyrotechnics, 4: 30-34.
-
(1979)
Propellants, Explosives, Pyrotechnics
, vol.4
, pp. 30-34
-
-
Kamlet, M.J.1
Adolf, H.G.2
-
50
-
-
33947651444
-
Chemistry of detonations. 1. Simple method for calculating detonation properties of C-H-N-O explosives
-
Kamlet, M. J. and S. J. Jacobs. 1968. Chemistry of detonations. 1. Simple method for calculating detonation properties of C-H-N-O explosives. Journal of Chemical Physics, 48: 23-36.
-
(1968)
Journal of Chemical Physics
, vol.48
, pp. 23-36
-
-
Kamlet, M.J.1
Jacobs, S.J.2
-
51
-
-
33645505899
-
Theoretical studies on the structures, thermodynamic properties, detonation properties, and, pyrolysis mechanisms of spiro nitramines
-
Qiu, L., H. Xiao, X. Gong, X. Ju, and W. Zhu. 2006. Theoretical studies on the structures, thermodynamic properties, detonation properties, and, pyrolysis mechanisms of spiro nitramines. Journal of Physical Chemistry A, 110: 3797-3807.
-
(2006)
Journal of Physical Chemistry A
, vol.110
, pp. 3797-3807
-
-
Qiu, L.1
Xiao, H.2
Gong, X.3
Ju, X.4
Zhu, W.5
-
52
-
-
27644449358
-
Theoretical study of the structures and properties of cyclic nitramines: Tetranitrotetraazadecalin (TNAD) and its isomers
-
Qiu, L., H. M. Xiao, X. H. Ju, and X. D. Gong. 2005. Theoretical study of the structures and properties of cyclic nitramines: Tetranitrotetraazadecalin (TNAD) and its isomers. International Journal of Quantum Chemistry, 105: 48-56.
-
(2005)
International Journal of Quantum Chemistry
, vol.105
, pp. 48-56
-
-
Qiu, L.1
Xiao, H.M.2
Ju, X.H.3
Gong, X.D.4
-
53
-
-
0442267285
-
DFT comparative studies on the structure and properties of heterocyclic nitramines
-
Xiao, J. J., J. Zhang, D. Yang, and H. M. Xiao. 2002. DFT comparative studies on the structure and properties of heterocyclic nitramines. Acta Chimica Sinica, 60: 2110-2114.
-
(2002)
Acta Chimica Sinica
, vol.60
, pp. 2110-2114
-
-
Xiao, J.J.1
Zhang, J.2
Yang, D.3
Xiao, H.M.4
-
54
-
-
30544437706
-
Theoretical studies on the vibrational spectra, thermodynamic properties, detonation properties, and pyrolysis mechanisms for polynitroadamantanes
-
Xu, X. J., H. M. Xiao, X. D. Gong, X. H. Ju, and Z. X. Chen. 2005. Theoretical studies on the vibrational spectra, thermodynamic properties, detonation properties, and pyrolysis mechanisms for polynitroadamantanes. Journal of Physical Chemistry A, 109: 11268-11274.
-
(2005)
Journal of Physical Chemistry A
, vol.109
, pp. 11268-11274
-
-
Xu, X.J.1
Xiao, H.M.2
Gong, X.D.3
Ju, X.H.4
Chen, Z.X.5
-
55
-
-
77953960678
-
Prediction of crystalline densities of polynitro arenes for estimation of their detonation performance based on quantum chemistry
-
Wang, G. X., X. D. Gong, Y. Liu, H. C. Du, and H. M. Xiao. 2010. Prediction of crystalline densities of polynitro arenes for estimation of their detonation performance based on quantum chemistry. Journal of Molecular Structure (Theochem), 953: 163-169.
-
(2010)
Journal of Molecular Structure (Theochem)
, vol.953
, pp. 163-169
-
-
Wang, G.X.1
Gong, X.D.2
Liu, Y.3
Du, H.C.4
Xiao, H.M.5
-
56
-
-
0032599862
-
Predicting Heats of formation of energetic materials using quantum mechanical calculations
-
Rice, B. M., S. V. Pai, and J. Hare. 1999. Predicting Heats of formation of energetic materials using quantum mechanical calculations. Combustion and Flame, 118: 445-448.
-
(1999)
Combustion and Flame
, vol.118
, pp. 445-448
-
-
Rice, B.M.1
Pai, S.V.2
Hare, J.3
|