Unit of theoretical and structural physico-chemistry

Activities

Activities per year 1987 2007 2009 2010 2011 2012 2013 2014 2015 2016 2018 2019 2022 2024 2025

• 417 Participation in conference
• 78 Participation in workshop, seminar, course
• 75 External Thesis
• 73 Participation to a Symposium, a study Day
• 231 More
  • 57 Oral presentation
  • 49 Publication peer-review
  • 45 Invited talk
  • 34 Research/Teaching in a external institution
  • 11 Visiting an external academic institution
  • 8 Membership of council
  • 6 Editorial activity
  • 6 Hosting a researcher
  • 6 Membership of committee
  • 4 Examination
  • 2 Membership of board
  • 1 Jury
  • 1 Hosting an academic visitor
  • 1 Other

Activities per year

Search results

• Visit within the bilateral collaboration with Prof. Anna Krawczuk and Dr. Marlena Gryl.

  Liegeois, V. (Contributor)

  21 Nov 2018

  Activity: Participating in or organising an event types › Participation in workshop, seminar, course

• Quantum chemistry-based design of nonlinear optical switches: from molecules in solution to functionalized surfaces

  Champagne, B. (Speaker)

  8 Oct 2018 → 12 Oct 2018

  Activity: Talk or presentation types › Invited talk

• Quantum chemistry-based design of nonlinear optical switches: from molecules in solution to functionalized surfaces

  Champagne, B. (Speaker)

  8 Oct 2018 → 12 Oct 2018

  Activity: Talk or presentation types › Invited talk

• Structural chemistry (Journal)

  Leherte, L. (Peer reviewer)

  2 Oct 2018

  Activity: Publication peer-review and editorial work types › Publication peer-review

• Quantum Chemistry and Computational Modelling section of the 2018 Norwegian National Meeting in Chemistry

  Liegeois, V. (Invited Speaker)

  17 Oct 2018

  Activity: Participating in or organising an event types › Participation in conference

• Adèle D. Laurent

  Leherte, L. (Host)

  17 Sept 2018 → 20 Sept 2018

  Activity: Hosting a visitor › Hosting a researcher

• MAGIC 2018

  Liegeois, V. (Contributor)

  24 Sept 2018

  Activity: Participating in or organising an event types › Participation in conference

• Rui Sousa

  Leherte, L. (Host)

  17 Sept 2018 → 20 Sept 2018

  Activity: Hosting a visitor › Hosting a researcher

• How the Second-Order Nonlinear Optical Response of the Collagen Triple Helix Appears: A Theoretical Investigation

  Champagne, B. (Speaker)

  2 Sept 2018 → 5 Sept 2018

  Activity: Talk or presentation types › Invited talk

• UV/vis absorption and resonant Raman spectra of dyes from quantum chemical calculations

  Champagne, B. (Speaker)

  13 Sept 2018

  Activity: Talk or presentation types › Invited talk

• Sixth International Conference on Vibrational Optical Activity (VOA6)

  Liegeois, V. (Contributor)

  13 Sept 2018

  Activity: Participating in or organising an event types › Participation in conference

• UMR 6200 CNRS

  Quertinmont, J. (Visiting researcher), Beaujean, P. (Visiting researcher) & Champagne, B. (Visiting researcher)

  11 Sept 2018 → 14 Sept 2018

  Activity: Visiting an external institution types › Visiting an external academic institution

• Towards Improving Thermochromism and Photochromism of Crystals and Co-Crystals: The Quantum Chemistry Component

  Champagne, B. (Speaker)

  26 Aug 2018 → 30 Aug 2018

  Activity: Talk or presentation types › Invited talk

• Workshop Olex2

  Van Gysel, M. (Participant)

  22 Aug 2018

  Activity: Participating in or organising an event types › Participation in workshop, seminar, course

• 31st European Crystallographic Meeting

  Van Gysel, M. (Poster)

  22 Aug 2018 → 27 Aug 2018

  Activity: Participating in or organising an event types › Participation in conference

• Thesis of Kornelia PIELAK, "Commutation of Second-Order Nonlinear Optical Responses of Indolino-Oxazolidines : from Molecules in Solution to Functionalized Surfaces"

  Champagne, B. (Supervisor)

  3 Jul 2018

  Activity: Examinations › External Thesis

• Université de Nantes

  Leherte, L. (Visiting researcher) & Vercauteren, D. (Visiting researcher)

  3 Jul 2018 → 7 Jul 2018

  Activity: Visiting an external institution types › Visiting an external academic institution

• Revisiting absorption and electronic circular dichroism spectra of cholesterol in solution: a joint experimental and theoretical study

  Bonvicini, A. (Speaker)

  21 Jun 2018

  Activity: Talk or presentation types › Oral presentation

• On the Relationships between Diradical/Multiradical Characters, (Non)Linear Optical Properties, and Magnetic Criteria of Aromaticity: a Theoretical Perspective

  Champagne, B. (Speaker)

  12 Jun 2018 → 16 Jun 2018

  Activity: Talk or presentation types › Invited talk

• Adèle D. Laurent

  Leherte, L. (Host)

  11 Jun 2018 → 15 Jun 2018

  Activity: Hosting a visitor › Hosting a researcher

• On the Relationships between Diradical/Multiradical Characters, (Non)Linear Optical Properties, and Magnetic Criteria of Aromaticity : a Theoretical Perspective

  Champagne, B. (Speaker)

  27 Jun 2018 → 28 Jun 2018

  Activity: Talk or presentation types › Invited talk

• 32èmes Journées Franco-Belges de Chimie Thérapeutique et 26èmes Rencontres Internationales des Pharmacochimistes de l'Arc Atlantique

  Van Gysel, M. (Poster)

  13 Jun 2018 → 15 Jun 2018

  Activity: Participating in or organising an event types › Participation in conference

• Chemical Bonding in the 21st Century - A one day Symposium in honor of Professor Roald HOFFMANN

  Liegeois, V. (Participant)

  28 May 2018

  Activity: Participating in or organising an event types › Participation in conference

• Groupe de Contact FNRS 'Calcul Intensif', 10th CÉCI Scientific Meeting

  Liegeois, V. (Contributor)

  4 May 2018

  Activity: Participating in or organising an event types › Participation in conference

• 10th CECI Scientific Meeting

  Louant, O. (Participant) & Quertinmont, J. (Participant)

  4 May 2018

  Activity: Participating in or organising an event types › Participation in conference

• On the Relationships between Diradical/Multiradical Characters, (Non)Linear Optical Properties, and Magnetic Criteria of Aromaticity: a Theoretical Perspective

  Champagne, B. (Speaker)

  28 May 2018

  Activity: Talk or presentation types › Invited talk

• Cholesterol electronic absorption in solution: the uncertain fate of Rydberg excited states in the condensed phases

  Bonvicini, A. (Speaker)

  15 May 2018

  Activity: Talk or presentation types › Oral presentation

• Thesis of Thijs STUYVER, "Qualitative Insights into the Transport Properties of Molecular Electronic Devices: A Quantum Chemical Approach" at VUB

  Champagne, B. (Jury Member)

  30 May 2018

  Activity: Examinations › External Thesis

• NanoWal Day

  Liegeois, V. (Organiser)

  25 May 2018

  Activity: Participating in or organising an event types › Participation in conference

• NanoWal Day

  Louant, O. (Participant), Beaujean, P. (Poster), Pielak, K. (Poster), Seelam, R. R. (Contributor), Quertinmont, J. (Participant) & Tetsassi Feugmo, C. G. (Participant)

  25 May 2018

  Activity: Participating in or organising an event types › Participation in conference

• Intrinsic Flexibility of the μ Opioid Receptor through Multiscale Modelling Approaches - COMP403

  Vercauteren, D. (Invited speaker), Fossepre, M. (Speaker), Leherte, L. (Speaker) & Laaksonen, A. (Speaker)

  21 Mar 2018

  Activity: Talk or presentation types › Invited talk

• ARC-Meeting: Engineering Responsive Materials

  Van Gysel, M. (Participant)

  23 Mar 2018

  Activity: Participating in or organising an event types › Participation in conference

• Narodowe Centrum Nauki (NCN - Poland) (External organisation)

  Leherte, L. (Chair)

  8 Mar 2018 → 31 Mar 2018

  Activity: Membership types › Membership of committee

• Influence of Protein-Solvent Interactions on the Molecular Dynamics of Reduced Point Charge Models of Proteins - COMP5

  Leherte, L. (Speaker) & Vercauteren, D. (Speaker)

  18 Mar 2018

  Activity: Talk or presentation types › Oral presentation

• Seminar at UMons in the laboratory of Prof. Roberto Lazzaroni

  Liegeois, V. (Contributor)

  7 Mar 2018

  Activity: Participating in or organising an event types › Participation in workshop, seminar, course

• Center for Advanced Study conference: Molecules in Extreme Environments in the honor of Dage Sundholm

  Liegeois, V. (Participant)

  15 Jan 2018 → 17 Jan 2018

  Activity: Participating in or organising an event types › Participation in conference

• Multi-scale approaches for investigating the linear and nonlinear optical properties of molecular and ionic crystals

  Champagne, B. (Speaker)

  12 Jan 2018

  Activity: Talk or presentation types › Invited talk

• PhD thesis of Nick VAN STERTEGHEM, " Molecular design in nonlinear optics : an experimental and computational perspective " at KULeuven

  Champagne, B. (Jury Member)

  9 Jan 2018

  Activity: Examinations › External Thesis

• Molecular Dynamics Simulations of Proteins using Reduced Point Charge Models

  Leherte, L. (Speaker)

  30 Jan 2018

  Activity: Talk or presentation types › Invited talk

• PhD Thesis of Alberto BAIARDI, " Development of computational methods for the simulation of vibrational and electronic spectra of medium-to-large sized molecular systems" at Scuola normale Superiore (Pisa, Italy)

  Champagne, B. (Jury Member)

  12 Jan 2018

  Activity: Examinations › External Thesis

• Visit at the Scuola normale Superiore of Pisa and presentation of a talk entitled "Multi-scale approaches for investigating the linear and nonlinear optical properties of molecular and ionic crystals"

  Champagne, B. (Speaker)

  18 Jan 2018

  Activity: Talk or presentation types › Oral presentation

• Quantum Chemistry in Belgium

  Beaujean, P. (Poster), Pielak, K. (Poster), Liégeois, V. (Poster), Adjieufack, A. I. (Poster) & Champagne, B. (Chairman)

  30 Jan 2018

  Activity: Participating in or organising an event types › Participation in conference

• Second- and Third-Order Nonlinear Optical Responses of Small Molecules: Interplay between Theory and Experiment

  Champagne, B. (Speaker)

  2018

  Activity: Talk or presentation types › Invited talk

• Current trends in membrane protein biophysics

  Dal Maso, T. (Poster)

  1 Dec 2017

  Activity: Participating in or organising an event types › Participation in conference

• Université de Sherbrooke

  Liegeois, V. (Visiting researcher)

  11 Sept 2017 → 13 Sept 2017

  Activity: Visiting an external institution types › Visiting an external academic institution

• Visit of the laboratory of Professor Armand Soldera

  Liegeois, V. (Contributor)

  12 Sept 2017

  Activity: Participating in or organising an event types › Participation in workshop, seminar, course

• PHD day of the EDT Pharmaceutical Sciences

  Dal Maso, T. (Contributor)

  13 Sept 2017

  Activity: Participating in or organising an event types › Participation in conference

• 31 èmes Journées Franco-Belges de Pharmacochimie

  Dal Maso, T. (Contributor)

  14 Sept 2017 → 15 Sept 2017

  Activity: Participating in or organising an event types › Participation in conference

• 11th European Conference on Theoretical and Computational Chemistry

  Louant, O. (Poster)

  4 Sept 2017 → 7 Sept 2017

  Activity: Participating in or organising an event types › Participation in conference

• Towards investigating the optical properties of molecular and ionic crystals using multi-scale approaches

  Champagne, B. (Invited speaker)

  Aug 2017 → Sept 2017

  Activity: Talk or presentation types › Invited talk