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Volumn 99, Issue 15, 1977, Pages 4899-4907

Ground States of Molecules. 38. The MNDO Method. Approximations and Parameters

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EID: 24444468650     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja00457a004     Document Type: Article
Times cited : (6053)

References (54)
  • 2
    • 85012381305 scopus 로고
    • Science, 190, 591 (1975).
    • See M. J. S. Dewar, Chem. Br., 11, 97 (1975); Science, 190, 591 (1975).
    • (1975) Dewar, Chem. Br. , vol.11 , pp. 97
    • See, M.J.S.1
  • 4
    • 0001574917 scopus 로고
    • G. G. Hall, Proc. R. Soc. London, Ser. A, 205, 541 (1951).
    • (1951) London, Ser , vol.205 , pp. 541
    • Hall, G.G.1
  • 5
    • 85012336343 scopus 로고
    • McGraw-Hill New York, N.Y.
    • See J. A. Pople and D. L. Beveridge, “Approximate Molecular Orbital Theory”, McGraw-Hill, New York, N.Y., 1970.
    • (1970)
    • See, J.A.1    Pople, D.L.2
  • 15
    • 34250481964 scopus 로고
    • Streitwieser
    • R. G. Jesaitis and A. Streitwieser, Chim. Acta., 17, 165 (1970);
    • (1970) Chim. Acta , vol.17 , pp. 165
    • Jesaitis, R.G.1
  • 17
    • 84913203893 scopus 로고
    • H. J. Koehler, Z. Chem., 13, 157 (1973);
    • (1973) Z. Chem. , vol.13 , pp. 157
  • 19
    • 85012311577 scopus 로고
    • Quantum Chemistry-The State of the Art
    • V. R. Saunders, Ed., Chilton, Oxford
    • M. A. Whitehead and G. D. Zeiss, “Quantum Chemistry-The State of the Art”, V. R. Saunders, Ed., Chilton, Oxford, 1974, p 185.
    • (1974) , pp. 185
    • Whitehead, M.A.1    Zeiss, G.D.2
  • 20
    • 84981813356 scopus 로고
    • 13, 29, 157(1973)
    • H. J. Koehler and F. Birnstock, Z.Chem., 12,196(1972); 13,29,157(1973);
    • (1972) , vol.12 , pp. 196
    • Koehler, H.J.1    Birnstock, F.2
  • 35
    • 14644387231 scopus 로고
    • B. Voigt, Theor. Chim. Acta, 31, 289 (1973).
    • (1973) Chim. Acta , vol.31 , pp. 289
    • Voigt, B.1
  • 36
    • 0013599704 scopus 로고
    • Proc. R. Soc. London, Ser. A, 264, 431 (1961)
    • M. J. S. Dewar and N. L. Hojvat (Sabelli), J. Chem. Phys., 34, 1232 (1961); Proc. R. Soc. London, Ser. A, 264, 431 (1961);
    • (1961) J. Chem. Phys. , vol.34 , pp. 1232
    • Dewar, M.J.S.1    Hojvat (Sabelli), N.L.2
  • 41
    • 85012404644 scopus 로고
    • Ph.D. Dissertation, The University of Texas at Austin, Austin, Texas
    • P. K. Weiner, Ph.D. Dissertation, The University of Texas at Austin, Austin, Texas, 1975.
    • (1975)
    • Weiner, P.K.1
  • 42
    • 85012388940 scopus 로고
    • University of Texas Center for Numerical Analysis, Report CNA-44, Austin, Texas
    • R. H. Bartels, University of Texas Center for Numerical Analysis, Report CNA-44, Austin, Texas, 1972.
    • (1972)
    • Bartels, R.H.1
  • 44
    • 42249095971 scopus 로고
    • Davidon
    • W. C. Davidon, Comput. J., 10, 406 (1968).
    • (1968) Comput. J. , vol.10 , pp. 406
  • 49
    • 85012310414 scopus 로고    scopus 로고
    • J. Am. Chem. Soc., to be published
    • M. J. S. Dewar and H. S. Rzepa, J. Am. Chem. Soc., to be published.
    • Dewar, M.J.S.1    Rzepa, H.S.2


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