Article
Ab initio methods for simulating and interpreting hyper-Raman spectra of molecules
Champagne, B., 2006, In : Lecture series on computer and computational sciences. 6, p. 317-323 7 p.Research output: Contribution to journal › Article
Ab initio polarizability and first hyperpolarizability of a push-pull polyene in the sum-over-states CI singles scheme
Champagne, B., Mosley, D. H., André, J-M., Spassova, M., Monev, V. & Kanev, I., 1999, In : Comptes rendus de l'Académie bulgare des sciences. 50, 6, p. 79-82 4 p.Research output: Contribution to journal › Article
AB-INITIO prediction of extremely large 1st hyperpolarizability of polyphosphaacetylene and polyphosphasilyne
Zhang, DY., Pouchan, C., Perpète, E. & Jacquemin, D., 2005, In : Chemical Physics Letters. 416, 4-6, p. 277-281 5 p.Research output: Contribution to journal › Article
Ab initio prediction of extremely large first hyperpolarizability of polyphosphaacetylene and polyphosphasilyne
Zhang, D. Y., Pouchan, C., Perpète, E. & Jacquemin, D., 2005, In : Chemical Physics Letters. 416, 4-6, p. 277-281 5 p.Research output: Contribution to journal › Article
Ab Initio QM Calculation of the Electric Field Convergence Versus Atomic Basis Sets in Periodic Models of Proton-Substituted Zeolites
Larin, A. V., Trubnikov, D. N. & Vercauteren, D. P., 1 Dec 2007, In : Internat. J. Quantum Chem.. 107, 15, p. 3137-3150 14 p.Research output: Contribution to journal › Article
Ab initio quantum chemical and ReaxFF-based study of the intramolecular iminium-enamine conversion in a proline-catalyzed reaction
Hubin, P. O., Jacquemin, D., Leherte, L., André, J. M., van Duin, A. C. T. & Vercauteren, D. P., 9 Aug 2012, In : Theoretical Chemistry Accounts. 131, 8, p. 1-11 11 p.Research output: Contribution to journal › Article
Ab initio quantum chemical calculations of polarizabilities of polymeric systems
Champagne, B., Fripiat, J. & André, J-M., 1994, In : Nonlinear optics. 6, p. 229-261 33 p.Research output: Contribution to journal › Article
Ab initio SCF-LCAO-MO study of conformational stability and internal rotation in n-butane, ethyl methyl ether and ethyl methyl sulphide
Bredas, J-L., Dufey, M., Fripiat, J. & André, J-M., 1983, In : Molecular physics. 49, 6, p. 1451-1460 10 p.Research output: Contribution to journal › Article
Ab initio simulation of the sum-frequency generation response of optically active liquids in the presence of a dc electric field - Determination of the absolute molecular configuration
Champagne, B. & Quinet, O., 16 Aug 2014, In : SCIENCE CHINA Chemistry. 57, 10, p. 1405-1408 4 p.Research output: Contribution to journal › Article
Ab initio static polarizability and first hyperpolarizability of model polymethineimine chains. II. Effects of conformation and of substitution by donor/acceptor end groups
Jacquemin, D., Champagne, B. & Kirtman, B., 1 Oct 1997, In : The journal of chemical physics. 107, 13, p. 5076-5087 12 p.Research output: Contribution to journal › Article
Ab initio studies of the static electronic first hyperpolarizability of polysilanenitrile
Zhang, D., Pouchan, C., Jacquemin, D. & Perpète, E., 2005, In : Chemical Physics Letters. 408, 4-6, p. 226-231 6 p.Research output: Contribution to journal › Article
Ab initio studies of the λ_max of naphthoquinones dyes
Perpète, E., Lambert, C., Wathelet, V., Preat, J. & Jacquemin, D., 2007, In : Spectrochimica Acta Part A : Molecular and Biomolecular Spectroscopy. 68, p. 1326-1333 8 p.Research output: Contribution to journal › Article
Ab initio study of the influence of aggregation on the infrared spectrum of acetonitrile
MATHIEU, N. V., DEFRANCESCHI, N. V. & Delhalle, J., 1993, In : Internat. J. Quantum. Chem. Symp.. 45, p. 735-746 12 p.Research output: Contribution to journal › Article
Ab initio tools for the accurate prediction of the visible spectra of anthraquinones
Jacquemin, D., Wathelet, V., Preat, J. & Perpète, E., 2007, In : Spectrochimica Acta Part A : Molecular and Biomolecular Spectroscopy. 67, 2, p. 334-341 8 p.Research output: Contribution to journal › Article
A biomimetic heteroditopic receptor for zwitterions in protic media
Cornut, D., Moerkerke, S., Wouters, J., Bruylants, G. & Jabin, I., 2015, In : Chemistry - An Asian Journal. 10, 2, p. 440-446 7 p.Research output: Contribution to journal › Article
A bio-process inspired synthesis of vaterite (CaCO<inf>3</inf>), directed by a rationally designed multifunctional protein, ChiCaSifi
Wang, X. L., Xie, H., Su, B. L., Cheng, Y. B., Xie, J. J., Ping, H., Wang, M. H., Zhang, J. Y., Zhang, F. & Fu, Z. Y., 7 Aug 2015, In : Journal of Materials Chemistry C. 3, 29, p. 5951-5956 6 p.Research output: Contribution to journal › Article
Abnormalities in cerebellum and brainstem in homozygous lurcher mice
Résibois, A. & Goffinet, A., 1998, In : Neuroscience. 80, p. 175-190 16 p.Research output: Contribution to journal › Article
Abnormal neural filtering of irrelevant visual information in depression
Desseilles, M., Balteau, E., Sterpenich, V., Dang-Vu, T. T., Darsaud, A., Vandewalle, G., Albouy, G., Salmon, E., Peters, F., Schmidt, C., Schabus, M., Gais, S., Degueldre, C., Phillips, C., Luxen, A., Ansseau, M., Maquet, P. & Schwartz, S., 4 Feb 2009, In : The Journal of neuroscience : the official journal of the Society for Neuroscience. 29, 5, p. 1395-403 9 p.Research output: Contribution to journal › Article
Aborder en classe de français le rôle de l'image de soi dans l'argumentation
Vrydaghs, D., Jan 2013, In : Échanges. 25, p. 19-24 6 p.Research output: Contribution to journal › Article
Aborder Hunger Games en classe de français? L'entrée du romanesque
Vrydaghs, D., Sep 2014, In : Échanges. 28, p. 37-45 9 p.Research output: Contribution to journal › Article
Aborder le post-exotisme d'Antoine Volodine en classe de français
Vrydaghs, D., 2016, In : Échanges. 31, p. 2-13 12 p.Research output: Contribution to journal › Article
Aborder le romanesque en classe de français
Vrydaghs, D., 2011, In : Enjeux. 82, p. 65-91 27 p.Research output: Contribution to journal › Article
About the mechanism of sterol biosynthesis
Krief, A., Schauder, J-R., Guittet, E., Herve Du Penhoat, C. & Lallemand, J-Y., 1 Jan 1987, In : Journal of the American Chemical Society. 109, 25, p. 7910-7911 2 p.Research output: Contribution to journal › Article
About the mechanism of the rearrangement of β-hydroxyalkylselenides to ketones
Krief, A., Laboureur, J. L., Evrard, G., Norberg, B. & Guittet, E., 1 Jan 1989, In : Tetrahedron Letters. 30, 5, p. 575-576 2 p.Research output: Contribution to journal › Article
About the relations between polarizability and Hartree-Fock instabilities. Part 1. The hydrogen molecule
Champagne, B., Deguelle, V. & André, J-M., 20 Feb 1995, In : Journal of Molecular Structure: THEOCHEM. 332, 1-2, p. 93-104 12 p.Research output: Contribution to journal › Article
A bovine 'Ia-like' antigen detected by a xenogeneic monoclonal antibody
Letesson, J-J., Coppe, P., Lostrie-Trussart, N. & Depelchin, A., 1983, In : Animal blood groups and biochemical genetics. 14, 4, p. 239-50 12 p.Research output: Contribution to journal › Article
A bracketing technique to ensure desirable convergence in univariate minimization.
Mifflin, R. & Strodiot, J-J., 1989, In : Mathematical Programming. 43, p. 117-130 14 p.Research output: Contribution to journal › Article
A bricolage perspective on service innovation
Witell, L., Gebauer, H., Jaakkola, E., Hammedi, W., Patricio, L. & Perks, H., 1 Oct 2017, In : Journal of Business Research. 79, p. 290-298 9 p.Research output: Contribution to journal › Article
A bridge between secondary and secular resonances inside the Hecuba gap
Henrard, J., Watanabe, N. & Moons, M., 1995, In : Icarus. 115, p. 336-346 11 p.Research output: Contribution to journal › Article
A brief history of filter methods
Fletcher, R., Leyffer, S. & Toint, P., 2007, In : SIAG/ OPT Views-and-News. 18, 1, p. 2-12 11 p.Research output: Contribution to journal › Article
A Brucella abortus cstA mutant is defective for association with endoplasmic reticulum exit sites and displays altered trafficking in HeLa cells
de Barsy, M., Mirabella, A., Letesson, J-J. & De Bolle, X., 2012, In : Microbiology. 158, Pt 10, p. 2610-8 9 p.Research output: Contribution to journal › Article
Absence of Estradiol production in FSH stimulated prepubertal calves.
de roover, N. V., leonard, N. V., feugang, N. V., genicot, N. V., delahaut, N. V., Bister, J-L. & dessy, N. V., 2002, In : Biotechnol. Agron. Soc. Environ.. 6, 1, p. 5-7 3 p.Research output: Contribution to journal › Article
Absolute absorption intensities in the fundamental v2 and v5 bands of 12CH3F
Lepère, M., Blanquet, G., Walrand, J. & Tarrago, G., 1 Jan 1998, In : Journal of molecular spectroscopy. 189, 2, p. 137-143 7 p.Research output: Contribution to journal › Article
Absolute intensity measurements in the v3 band of carbon disulphide
Blanquet, G., Walrand, J., Weber, C. & Lepère, M., 20 Jun 2003, In : Molecular physics. 101, 12, p. 1911-1917 7 p.Research output: Contribution to journal › Article
Absolute line intensities and self-broadening coefficients in the v1 band of 35Cl12C14N
Blanquet, G., Walrand, J., Bouanich, J-P. & Lepère, M., 1 Jan 2001, In : Journal of molecular spectroscopy. 206, 2, p. 143-149 7 p.Research output: Contribution to journal › Article
Absolute line intensities and self-broadening coefficients in the ν3-ν1 band of carbon dioxide
Delière, Q., Fissiaux, L. & Lepère, M., 1 Feb 2012, In : Journal of molecular spectroscopy. 272, 1, p. 36-42 7 p.Research output: Contribution to journal › Article
Absolute line intensities determination in the ν7 band of C2H4
Walrand, J., Lengelé, M., Blanquet, G. & Lepère, M., 1 Feb 2003, In : Spectrochimica acta Part A-Molecular and Biomolecular Spectroscopy. 59, 3, p. 421-426 6 p.Research output: Contribution to journal › Article
Absolute Line Intensities in the 2v3 Band of O12CS
Bermejo, D., Domenech, J. L., Santos, J., Bouanich, J-P. & Blanquet, G., 1 Sep 1997, In : Journal of molecular spectroscopy. 185, 1, p. 26-30 5 p.Research output: Contribution to journal › Article
Absolute Line Intensities in the 2ν2 Band of Cyanogen Chloride at 12.8 μm
Lepère, M., Blanquet, G. & Walrand, J., 1 May 2000, In : Journal of molecular spectroscopy. 201, 1, p. 151-155 5 p.Research output: Contribution to journal › Article
Absolute Line Intensities in the 6.7 μm ν6 Fundamental Band of CH3NC
Blanquet, G. & Walrand, J., 1 Aug 1997, In : Journal of molecular spectroscopy. 184, 2, p. 464-465 2 p.Research output: Contribution to journal › Article
Absolute Line Intensities in the ν2 Band of 12CH335Cl at Cl 7.5 μm
Blanquet, G., Lance, B., Walrand, J. & Bouanich, J. P., 1 Apr 1995, In : Journal of molecular spectroscopy. 170, 2, p. 466-477 12 p.Research output: Contribution to journal › Article
Absolute line intensities in the ν2 band of CH3Cl at 7.5 μm
Blanquet, G., Lance, B., Walrand, J. & Bouanich, J-P., 30 Jul 1996, In : Spectrochimica acta Part A-Molecular and Biomolecular Spectroscopy. 52, 8 PART 3, p. 1033-1035 3 p.Research output: Contribution to journal › Article
Absolute line intensities in the ν3 band of 12CH3F at 9.6 μm
Lepere, M., Blanquet, G. & Walrand, J., 30 Jul 1996, In : Spectrochimica acta Part A-Molecular and Biomolecular Spectroscopy. 52, 8 PART 3, p. 1029-1031 3 p.Research output: Contribution to journal › Article
Absolute line intensities in the ν3 band of 12CH3F by diode-laser spectroscopy
Lepère, M., Blanquet, G. & Walrand, J., 1 Jun 1996, In : Journal of molecular spectroscopy. 177, 2, p. 307-310 4 p.Research output: Contribution to journal › Article
Absolute Line Intensities of the ν6 Band of CH335Cl at 10 μm
Blanquet, G., Walrand, J. & Dang-Nhu, M., 1 May 1993, In : Journal of molecular spectroscopy. 159, 1, p. 156-160 5 p.Research output: Contribution to journal › Article
Absolute line intensities of the ν9 band of propyne at 15.5 μm
Blanquet, G., Walrand, J. & Dang-Nhu, M., 1 Sep 1992, In : Spectrochimica acta Part A-Molecular and Biomolecular Spectroscopy. 48, 9, p. 1231-1233 3 p.Research output: Contribution to journal › Article
Absolute line intensity measurements of hot bands for carbonyl sulfide at 12 μm
Walrand, J., Lengelé, M. & Blanquet, G., 1 Dec 2004, In : Spectrochimica acta Part A-Molecular and Biomolecular Spectroscopy. 60, 14, p. 3299-3303 5 p.Research output: Contribution to journal › Article
Absorption and emission spectra in gas-phase and solution using TD-DFT: formaldehyde and benzene as case studies
Jacquemin, D., Perpète, E., Scalmani, G., Frisch, M., Ciofini, I. & Adamo, C., 2006, In : Chemical Physics Letters. 42, p. 272-276 5 p.Research output: Contribution to journal › Article
Absorption and emission spectra of 1,8-naphthalimide fluorophores: A PCM-TD-DFT investigation
Jacquemin, D., Perpete, E., Scalmani, G., Ciofini, I., Peltier, P. & Adamo, C., 2010, In : Chemical physics.Research output: Contribution to journal › Article
Absorption and exchange properties of polyamines on isolated plant cell walls
Messiaen, J. & Van Cutsem, P., 1998, In : Archives of Physiology and Biochemistry. 105, 4, p. 11-11 1 p.Research output: Contribution to journal › Article