Denis Jacquemin

Prof. Dr. Denis Jacquemin

CEISAM Lab, UMR CNRS 6230, Science and Technology Faculty, BP 92208, University of Nantes, 2, rue de la Houssinière, 44322 Nantes Cedex 3 France

Research Focus & Metrics

Academic Career Length

32Years (1995-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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2 November 2012 in Chemical Society Reviews
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Journal Article
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CACarlo Adamo
Carlo Adamo
Denis JacqueminDenis Jacquemin
Denis Jacquemin
In this tutorial review, we show how Time-Dependent Density Functional Theory (TD-DFT) has become a popular tool for computing the signatures of electronically excited states, and more specifically, the properties directly related to the optical (absorption and emission) spectra of molecules. We discuss the properties that can be obtained with widely available programs as well as how to account for the environmental effects (solvent and surfaces) and present recent applications in these fields. We next expose the transformation of the TD-DFT results into chemically intuitive parameters (colours as well as charge-transfer distances). Eventually, the non-specialised reader will find a series of advices and warnings necessary to perform her/his first TD-DFT calculations.

9 April 2013 in International Journal of Quantum Chemistry
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Journal Article
Closed access
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ALAdèle D. Laurent
Adèle D. Laurent
Denis JacqueminDenis Jacquemin
Denis Jacquemin

11 August 2009 in Journal of Chemical Theory and Computation
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Journal Article
Closed access
Denis JacqueminDenis Jacquemin
Denis Jacquemin
VWValérie Wathelet
Valérie Wathelet
EPEric A. Perpète
Eric A. Perpète
CACarlo Adamo
Carlo Adamo

17 November 2007 in Journal of Chemical Theory and Computation
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Journal Article
Closed access
Denis JacqueminDenis Jacquemin
Denis Jacquemin
EPEric A. Perpète
Eric A. Perpète
GSGustavo E. Scuseria
Gustavo E. Scuseria
ICIlaria Ciofini
Ilaria Ciofini
CACarlo Adamo
Carlo Adamo

12 April 2000 in The Journal of Physical Chemistry A
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Journal Article
Closed access
Benoit CHAMPAGNEBenoit CHAMPAGNE
Benoit CHAMPAGNE
EPEric A. Perpète
Eric A. Perpète
Denis JacqueminDenis Jacquemin
Denis Jacquemin
SGStan J. A. van Gisbergen
Stan J. A. van Gisbergen
EBEvert-Jan Baerends
Evert-Jan Baerends
BKBernard Kirtman
Bernard Kirtman

2 July 2018 in Journal of Chemical Theory and Computation
Verified
Journal Article
Closed access
PLPierre-François Loos
Pierre-François Loos
ASAnthony Scemama
Anthony Scemama
ABAymeric Blondel
Aymeric Blondel
YGYann Garniron
Yann Garniron
MCMichel Caffarel
Michel Caffarel
Denis JacqueminDenis Jacquemin
Denis Jacquemin