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Displaying 10 results.
    • Journal article
    Information-theory and Basis Set Quality, Automatic Classification and Systematic Improvement of Approximate Wavefunctions .3. a Study On H2o (1a2/12a2/11b2/23a2/11b2/1,1a1)
    Maroulis, G. Sana, M. Leroy, Georges[UCL] (1985) Journal of Molecular Structure: THEOCHEM — Vol. 22, no. MAR, p. 69-78 (1985)
    • Journal article
    The Theoretical-study of Chemical Intermediates
    Leroy, Georges[UCL] (1985) Journal of Molecular Structure: THEOCHEM — Vol. 21, no. FEB, p. 91-106 (1985)
    • Journal article
    Information theory and basis set quality. Automatic classification and systematic improvement of approximate wavefunctions. IV. A study on BH(/b X//sup 1/ Sigma /sup +/), CH(/b X//sup 2/ Pi /sub r/) and NH(/b X//sup 3/ Sigma /sup -/)
    Maroulis, G. Sana, M. Leroy, Georges[UCL] (1985) Journal of Molecular Structure: THEOCHEM — Vol. 23, no. 3-4, p. 269-280 (1985)
    • Journal article
    A Theoretical Investigation of the Properties of Carbocations and Carbanions
    Leroy, Georges[UCL] Wilante, Claude[UCL] Peeters, Daniel[UCL] Uyewa, MM. (1985) Journal of Molecular Structure: THEOCHEM — Vol. 25, no. 1-2, p. 107-131 (1985)
    • Journal article
    Quelques Aspects de la Chimie Theorique Contemporaine
    Leroy, Georges[UCL] (1985) Societes Chimiques Belges. Bulletin — Vol. 94, no. 11-12, p. 945-989 (1985)
    • Journal article
    The Theoretical Approach To Some Chemical Problems
    Leroy, Georges[UCL] (1985) Advances in Quantum Chemistry — Vol. 17, p. 1-95 (1985)
    • Journal article
    Stereoelectronic Effect in Anionic 1,1-addition To Isocyanides - An Abinitio Study of the H- + Hnc System
    Nguyen, MT. Hegarty, AF. Sana, M. Leroy, Georges[UCL] (1985) Journal of the American chemical society — Vol. 107, no. 14, p. 4141-4145 (1985)
    • Journal article
    Information-theory and Basis Set Quality - Automatic Classification and Systematic Improvement of Approximate Wavefunctions .4. a Study On Bh(x1sigma+), Ch(x2pir) and Nh(x3sigma-)
    Maroulis, G. Sana, M. Leroy, Georges[UCL] (1985) Journal of Molecular Structure: THEOCHEM — Vol. 23, no. 3-4, p. 269-280 (1985)
    • Journal article
    Étude théorique des réactions d'abstraction d'hydrogène, avec R, X≡H, CH3, NH2,OH et F
    Leroy, Georges[UCL] Sana, M. Tinant, A. (1985) Canadian Journal of Chemistry — Vol. 63, no. 7, p. 1447-1456 (1985)
    • Journal article
    The electronic structure of chemical species
    Leroy, Georges[UCL] Peeters, Daniel[UCL] Tihange, M. (1985) Journal of Molecular Structure: THEOCHEM — Vol. 24, no. 3-4, p. 243-258 (1985)