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Volumn 102, Issue 43, 1998, Pages 8386-8392

A transferable intermolecular potential for nitramine crystals

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Indexed keywords


EID: 0000764721     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9820525     Document Type: Article
Times cited : (70)

References (62)
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    • Russell, T. P.; Miller, P. J.; Piermarini, G. J.; Block, S.; Gilardi, R.; George, C. AD-CO48 931 (92-0134), p 155, Apr 91, CPIA Abstract No. 92, 0149. ADD604 542. C-D, Chemical Propulsion Information Agency, 10630 Little Patuxent Parkway, Suite 202, Columbia, MD 21044-3200.
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    • and references therein
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    • Möller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Hehre, W. J.; Ditchfield, R.; Pople, J. A. J. Chem. Phys. 1972, 56, 2257. Hariharan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213. Gordon, M. S. Chem. Phys. Lett. 1980, 76, 163.
    • (1934) Phys. Rev. , vol.46 , pp. 618
    • Möller, C.1    Plesset, M.S.2
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    • 0347170005 scopus 로고
    • Möller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Hehre, W. J.; Ditchfield, R.; Pople, J. A. J. Chem. Phys. 1972, 56, 2257. Hariharan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213. Gordon, M. S. Chem. Phys. Lett. 1980, 76, 163.
    • (1972) J. Chem. Phys. , vol.56 , pp. 2257
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    • Möller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Hehre, W. J.; Ditchfield, R.; Pople, J. A. J. Chem. Phys. 1972, 56, 2257. Hariharan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213. Gordon, M. S. Chem. Phys. Lett. 1980, 76, 163.
    • (1973) Theor. Chim. Acta , vol.28 , pp. 213
    • Hariharan, P.C.1    Pople, J.A.2
  • 18
    • 85022583881 scopus 로고
    • Möller, C.; Plesset, M. S. Phys. Rev. 1934, 46, 618. Hehre, W. J.; Ditchfield, R.; Pople, J. A. J. Chem. Phys. 1972, 56, 2257. Hariharan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213. Gordon, M. S. Chem. Phys. Lett. 1980, 76, 163.
    • (1980) Chem. Phys. Lett. , vol.76 , pp. 163
    • Gordon, M.S.1
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    • Hohenber, P.; Kohn, W. Phys. Rev. 1964, B126, 864. Parr, R. G.; Yand, W. Density-Functional Theory of Atoms and Molecules; Oxford University Press: New York, 1989.
    • (1964) Phys. Rev. , vol.B126 , pp. 864
    • Hohenber, P.1    Kohn, W.2
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    • Y coordinate of N1 given as 0.0599 in Table 2 should be negative
    • (f) Cady, H. H.; Larson, A. C.; Cromer, D. T. Acta Crystallogr. 1963, 16, 617 (Y coordinate of N1 given as 0.0599 in Table 2 should be negative).
    • (1963) Acta Crystallogr. , vol.16 , pp. 617
    • Cady, H.H.1    Larson, A.C.2    Cromer, D.T.3
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    • Private communication
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    • (1997)
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    • Fox, D., Labes, M. M., Weissberger, A., Eds.; Wiley: New York
    • McCrone, W. C. In Physics and Chemistry of the Organic Solid State; Fox, D., Labes, M. M., Weissberger, A., Eds.; Wiley: New York, 1965; Vol. II, pp 726-766.
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.