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  1. No Access

    Article

    Distributed Gaussian orbitals for the description of electrons in an external potential

    In this work, we demonstrate the viability of using distributed Gaussian orbitals as a basis set for the calculation of the properties of electrons subjected to an external potential. We validate our method by...

    Léa Brooke, Alejandro Diaz-Marquez, Stefano Evangelisti… in Journal of Molecular Modeling (2018)

  2. No Access

    Article

    Optical properties from time-dependent current-density-functional theory: the case of the alkali metals Na, K, Rb, and Cs

    We present the optical conductivity as well as the electron-energy loss spectra of the alkali metals Na, K, Rb, and Cs calculated within time-dependent current-density functional theory. Our ab initio formulat...

    R. Ferradás, J. A. Berger, Pina Romaniello in The European Physical Journal B (2018)

  3. No Access

    Article

    A rational reduction of CI expansions: combining localized molecular orbitals and selected charge excitations

    Based on localized molecular orbitals, the proposed method reduces large configuration interaction (CI) spaces while maintaining agreement with reference values. Our strategy concentrates the numerical effort ...

    Tim Krah, Nadia Ben Amor, Daniel Maynau, J. A. Berger… in Journal of Molecular Modeling (2014)

  4. No Access

    Article

    Efficient calculation of the polarizability: a simplified effective-energy technique

    In a recent publication [J.A. Berger, L. Reining, F. Sottile, Phys. Rev. B 82, 041103(R) (2010)] we introduced the effective-energy technique to calculate in an accurate and numerically efficient manner the GW se...

    J. A. Berger, L. Reining, F. Sottile in The European Physical Journal B (2012)

  5. No Access

    Article

    N-Dephenylated and N-phenyl urinary metabolites of mociprazine (CERM 3517) in beagle dogs after oral administration. A mass spectrometric determination

    CERM 3S17 (mociprazine), a new anti-emetic compound, was administered orally to six beagle dogs at 10 mg/kg b.i.d. for four days. Unconjugated urinary metabolites were identified by GC-MS analysis against synt...

    A. Enreille, J. F. Pognat, M. J. Galmter… in European Journal of Drug Metabolism and Ph… (1991)

  6. No Access

    Article

    Chronopharmacokinetic and bioequivalence studies of two formulations of trimipramine after oral administration in man

    The bioavailability of two oral formulations of trimipramine, tablets and solution, was performed in twelve healthy volunteers, in a cross-over study. Each formulation was administered in the morning after a f...

    A. M. Bougerolle, J. L. Chabard, M. Jbilou… in European Journal of Drug Metabolism and Ph… (1989)

  7. No Access

    Article

    Kinetics of metapramine and its demethylated metabolites after single and chronic oral administration in man

    The kinetics of metapramine and two of its demethylated metabolites were determined in six normal subjects after oral administration of a single 150 mg dose on day 1 and 3 × 50 mg dose on day 2–6. This study h...

    A. M. Bougerolle, J. L. Chabard, G. Dordain… in European Journal of Drug Metabolism and Ph… (1986)

  8. No Access

    Article

    Pharmacokinetic study of3H-labelled PAF-acether II. Comparison with3H-labelled lyso-PAF-acether after intravenous administration in the rabbit and protein binding

    The blood and plasma kinetics of intravenously administered3H-labelled PAF-acether were determined in seven rabbits. PAF-acether was rapidly distributed and slowly eliminated. Individual variations were very smal...

    C. Lartigue-Mattei, D. Godeneche, J. L. Chabard, J. Petit… in Agents and Actions (1984)

  9. No Access

    Article

    Possibilites d'application en analyse bromatologique de la chromatographie sur couches minces d'echangeurs d'ions et sur couches multiples juxtaposees

    En analyse bromatologique, la chromatographie sur couches minces classiques a été appliquée jusqu'alors essentiellement à des séparations de composés organiques. Il n'est pas doûteux cependant, que l'utilisati...

    J. A. Berger, J. Petit in Qualitas Plantarum et Materiae Vegetabiles (1968)