Displaying 1 - 30 of 156 results.

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    • Journal article
    Absorption Spectra of Recently Synthesised Organic Dyes: A TD-DFT Study
    Jacquemin, Denis Preat, Julien Perpète, Eric A. Adamo, Carlo (2010) International journal of quantum chemistry — vol. 110, no. 12, p. 2121-2129 (2010)
    • Journal article
    A UV/VIS spectra investigation of pH-sensitive dyes using time-dependent density functional theory
    Preat, Julien Jacquemin, Denis Perpète, Eric A. (2010) International journal of quantum chemistry — vol. 110, no. 12, p. 2147-2154 (2010)
    • Journal article
    Long-range effects in optimizing the geometry of stereoregular polymers. I. Formalism
    Jacquemin, Denis André, Jean-Marie Champagne, Benoit (1999) The journal of chemical physics — vol. 111, no. 12, p. 5306-5323 (2007)
    • Journal article
    Design of New Triphenylamine-Sensitized Solar Cells: A Theoretical Approach
    Preat, Julien Jacquemin, Denis Perpète, Eric A. (2010) Environmental science & technology — vol. 44, no. 14, p. 5666-5671 (2004)
    • Journal article
    Convergence of exchange lattice summations in direct-space polymer calculations
    Jacquemin, Denis Fripiat, Joseph G. Champagne, Benoit (2002) International journal of quantum chemistry — vol. 89, no. 5, p. 452-463 (2007)
    • Journal article
    Long-range effects in optimizing the geometry of stereoregular polymers - IV : Explicit determination of the helical angle
    Jacquemin, Denis Champagne, Benoît (2001) International journal of quantum chemistry — vol. 85, no. 4-5, p. 539-545 (2007)
    • Journal article
    Stepwise hydration of protonated proline
    Michaux, Catherine Wouters, Johan Perpète, Eric A. Jacquemin, Denis (2008) Journal of Physical Chemistry B — vol. 112, no. 26, p. 7702-7705 (2007)
    • Journal article
    Asymmetric unit cell polymers with large first hyperpolarizabilities
    Jacquemin, Denis Champagne, Benoît André, Jean-Marie (1999) Synthetic Metals — vol. 101, no. 1, p. 490-491 (2007)
    • Journal article
    Ab Initio Investigation of the Hydration of Deprotonated Amino Acids
    Michaux, Catherine Wouters, Johan Perpète, Eric A. Jacquemin, Denis (2009) Journal of the American Society for Mass Spectrometry — vol. 20, no. 4, p. 632-638 (2011)
    • Journal article
    Ab initio band structure of polymethineimine isomers
    Jacquemin, Denis Champagne, Benoît André, Jean-Marie (1998) The journal of chemical physics — vol. 108, no. 3, p. 1023-1030 (2007)
    • Journal article
    Photochromic molecular wires : Insights from theory
    Jacquemin, Denis Michaux, Catherine Perpète, Eric A. Maurel, François Perrier, Aurélie (2010) Chemical Physics Letters — vol. 488, no. 4-6, p. 193-197 (1998)

Pages