Marc DE WERGIFOSSE

Source: Scopus
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Personal profile

Awards

Annual price granted by the “Société Royale de Chimie” for the best master thesis in 2006 at the Université de Liège

Diplomas

Master of Advanced Studies in Physics - Université de Liège
Master in Chemistry - Université de Liège

Awards

Annual price granted by the “Société Royale de Chimie” for the best master thesis in 2006 at the Université de Liège

Diplomas

Master of Advanced Studies in Physics - Université de Liège
Master in Chemistry - Université de Liège

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1 Active
5 Finished

Quantum chemical design of open-shell nonlinear optical materials
CHAMPAGNE, B., SEIDLER, T., DE WERGIFOSSE, M. & Nakano, M.
1/04/14 → 31/12/21
Project: Research
Quantum chemical design of open-shell nonlinear optical materials
Nakano, M., CHAMPAGNE, B., Plaquet, A., Liegeois, V., DE WERGIFOSSE, M. & SEIDLER, T.
1/01/14 → 31/12/15
Project: Research
Optique non-linéaire de systèmes complexes: modélisation et interprétation
DE WERGIFOSSE, M. & CHAMPAGNE, B.
1/01/09 → 31/08/15
Project: PHD
Elaboration of quantum chemistry procedures to predict and interpret intermolecular interactions effects on the properties of organic materials
CHAMPAGNE, B., BOTEK, E., DE WERGIFOSSE, M., KANOUN, M. B. & SEIDLER, T.
1/01/08 → 31/12/17
Project: Research
Functional Supramolecular Systems (PAI P6/27)
CHAMPAGNE, B., Wouters, J., BOTEK, E., DE WERGIFOSSE, M., GUTHMULLER, J., Liegeois, V., NORBERG, B., Plaquet, A., STAELENS, N. & Vercauteren, D.
1/01/07 → 31/12/11
Project: Research

373 Citations
9 h-Index
16 Article
1 Chapter (peer-reviewed)
1 Paper
1 Doctoral Thesis

Dynamic Structural Effects on the Second-Harmonic Generation of Tryptophane-Rich Peptides and Gramicidin A
Seibert, J., Champagne, B., Grimme, S. & De Wergifosse, M., 2 Apr 2020, In: Journal of physical chemistry B. 124, 13, p. 2568-2578 11 p.
Research output: Contribution to journal › Article › peer-review
Are Fully Conjugated Expanded Indenofluorenes Analogues and Diindeno[n]thiophene Derivatives Diradicals? A Simplified (Spin-Flip) Time-Dependent Density Functional Theory [(SF-)sTD-DFT] Study
De Wergifosse, M., Seibert, J., Champagne, B. & Grimme, S., 14 Nov 2019, In: Journal of physical chemistry A. 123, 45, p. 9828-9839 12 p.
Research output: Contribution to journal › Article › peer-review
ONIOM Investigation of the Second-Order Nonlinear Optical Responses of Fluorescent Proteins
De Wergifosse, M., Botek, E., De Meulenaere, E., Clays, K. & Champagne, B., 17 May 2018, In: Journal of physical chemistry A. 122, 19, p. 4993-5005 13 p.
Research output: Contribution to journal › Article › peer-review
Quantum Chemical Methods for Predicting and Interpreting Second-Order Nonlinear Optical Properties: from Small to Extended π-Conjugated Molecules
Champagne, B., Beaujean, P., De Wergifosse, M., Hidalgo Cardenuto, M., Liégeois, V. & Castet, F., 2018, In: Frontiers in Quantum Chemistry. p. 117-138 21 p.
Research output: Contribution to journal › Article › peer-review

Open Access
File
7 Downloads (Pure)
Theoretical Study on Third-Order Nonlinear Optical Property of One-Dimensional Cyclic Thiazyl Radical Aggregates: Intermolecular Distance, Open-Shell Nature, and Spin State Dependences
Matsui, H., Yamane, M., Tonami, T., Nakano, M., De Wergifosse, M., Seidler, T. & Champagne, B., 29 Mar 2018, In: Journal of Physical Chemistry C. 122, 12, p. 6779-6785 7 p.
Research output: Contribution to journal › Article › peer-review

24 Participation in conference
3 Research/Teaching in a external institution
1 Participation in workshop, seminar, course
1 Visiting an external academic institution

Japan Society for the Promotion of Science - JSPS - FNRS Seminar
Marc De Wergifosse (Invited Speaker)
3 Jul 2015
Activity: Participating in or organising an event types › Participation in conference
Osaka University
Marc De Wergifosse (Visiting researcher)
28 Jun 2015 → 8 Jul 2015
Activity: Visiting an external institution types › Visiting an external academic institution
Modeling Photoactive Molecules (MPM) Conference
Marc De Wergifosse (Contributor)
21 Apr 2015 → 24 Apr 2015
Activity: Participating in or organising an event types › Participation in conference
The Workshop on Non-linear Imaging and Microscopy in Biology and Materials Science
Marc De Wergifosse (Participant)
12 Apr 2015 → 15 Apr 2015
Activity: Participating in or organising an event types › Participation in workshop, seminar, course
Organext Generation & IAP-FS2 & Solliance Winterschool
Marc De Wergifosse (Contributor)
27 Jan 2015
Activity: Participating in or organising an event types › Participation in conference

Quantum chemical investigations of nonlinear optical compounds: from model to complex systems for second harmonic imaging microscopy
Author: de Wergifosse, M., 29 Apr 2014
Supervisor: Champagne, B. (Supervisor), Wouters, J. (President), Liegeois, V. (Jury), Clays, K. (External person) (Jury), Leyssens, T. (External person) (Jury) & BEARPARK, M. J. (External person) (Jury)
Student thesis: Doc types › Doctor of Sciences