Hello our valued visitor, We present you the best web solutions and high quality graphic designs with a lot of features. just login to your account and enjoy ...


Conferences and courses

List of QCEXVAL members contributions at 2016

  • Conference:  “Excited States: Bridging Scales”

    7-10 November, 2016. Marselle, France.

    • Javier Segarra-Martí, Ana Julieta Pepino, Vishal K. Jaiswal, Angelo Giussani, Artur Nenov, Shaul Mukamel, Ivan Rivalta y Marco Garavelli
      Oral Communication:“2D Electronic Spectroscopy: a diagnostic tool to track molecular conformation in DNA/RNA aggregates”


  • Course SHARC Workshop 2016″

    3-7 October, 2016. Vienna, Austria.
    Organizing entity: Quantum Chemistry and Chemical Dynamics research group, Institute for Theoretical Chemistry, Universität Wien.
    Chairman: Prof. Leticia González
    Participant: Antonio Francés-Monerris


  • Conference:   Vth Spanish-Portuguese Conference on Photochemistry”

    7-10 September, 2016. Toledo, Spain.

    • M. Marazzi, H. Gattuso,D. Roca-Sanjuán, L. González, A. Monari
      Oral Communication:“From non-covalent binding to irreversible DNA lesions: Organic dyes as photosesitizing agents”
    • D. Roca-Sanjuán, M.Marazzi, M. Wibowo, D.-C. Sergentu, E. Dumont, A. Francés-Monerris, M. Merchán
      Póster:“DNA photosensitisation: A theoretical insight”



  • Conference:   “EJD-TCCM 1st Annual Meeting”

    18-20 July, 2016. Paris, France.

    • M. A. Izquierdo
      Oral Communication:“The discrete reaction field model for large scale modeling of organic photovoltaics”


  • Conference“10th Congress on Electronic Structures: Principles and Applications – ESPA 2016”

    28 June – 1st July, 2016. Castellón de la Plana, Spain.

    • D. Roca-Sanjuán, M. Merchán, A. Francés-Monerris
      Oral Communication:“Applications of non-adiabatic chemistry in biology and technology”
    • A. Francés-Monerris, F. A. Augusto, I. Fdez.-Galván, D. Roca-Sanjuán, E. L. Bastos, W. J. Baader and R. Lindh
      Póster:“On the unimolecular and bimolecular chemiluminescence mechanisms”
    • M. Rubio, M. Wibowo, A. Más-Esteve and D. Roca-Sanjuán
      Póster:“Spectroscopy and photophysical properties of porphycene: a RASSPT2 study”
    • S. P. Sitkiewicz, A. Saiz-López, R. Notario, J. Z. Dávalos, J. M. Oliva and D. Roca-Sanjuán
      Póster:“Atmospheric chemistry under a loupe-theoretical study on light absortion by halogen compounds” 
    • M. Marazzi, S. Mai, H. Gattuso, D. Roca-Sanjuán, L. González and A. Monari
      Póster:“Benzophenone mediated DNA photosensitization: Energy transfer and hydrogen abstraction mechanisms”
    • V. Pérez-Mondéjar, A. Francés-Monerris, M. Merchán, D. Roca-Sanjuán and V. Veryazov
      Póster:“Different hardware and software strategies for an efficent use of MolCAS 8”




  • Conference: Molcas Developers Workshop”

    30 March – 1 April, 2016. Wien, Austria.

    • J. Martí-Segarra, Marco Garavello and Francesco Aquilante
      Oral Comunication:“Nonlinear Bidimensional Spectroscopy Based on Frozen Natural Orbital PT2 Approaches with MOLCAS”
    • V. Pérez-Mondéjar


  • Congress: “7th European Symposium on Computing π-Conjugated Compounds”

    12-13 February 2016, Bourdeaux, France.

    • A. Francés-Monerris, J. Segarra-Martí, M. Merchán, and D. Roca-Sanjuán
      Oral Communication:“On the competition between the intra- and inter-strand photochemical pathways in the Guanine-Cytosine/Cytosine trimer: A CASSCF/CASPT2 study”
    • D. Roca-Sanjuán, A. Francés-Monerris, and P. Farahani
      Oral Communication:“Non-adiabatic processes in photochemistry, chemiluminescene, and dark photochemistry”
    • M. Marazzi, S. Mai, H. Gattuso, D. Roca-Sanjuán, L. González, and A. Monari
      Oral Communication:“DNA photosensitization by benzophenone: Feasibility and relevance of energy transfer and hydrogen abstraction mechanisms”

Este sitio web utiliza cookies para que usted tenga la mejor experiencia de usuario. Si continúa navegando está dando su consentimiento para la aceptación de las mencionadas cookies y la aceptación de nuestra política de cookies, pinche el enlace para mayor información.plugin cookies

Aviso de cookies