Martial Boggio-Pasqua

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 32

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry. A

Molecules (Basel, Switzerland)

Chemistry (Weinheim an der Bergstrasse, Germany)

CNRS Délégation Midi-Pyrénées

Université Bordeaux 1 (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

CNRS Délégation Midi-Pyrénées Oct 01 2007

France

Chargé de Recherche :: Laboratoire de Chimie et Physique Quantiques

Imperial College London Jan 01 2004 - Jul 01 2007

United Kingdom

Research Associate :: Chemistry

King's College London Mar 01 2000 - Dec 31 2003

United Kingdom

Research Associate :: Chemistry

Université de Bordeaux 1 Sep 01 1999 - Feb 28 2000

France

Attaché Temporaire à l'Enseignement et la Recherche :: Laboratoire de Physico-Chimie Moléculaire

Education History

Université Bordeaux 1 - Nov 23 1999

France

PHD :: Laboratoire de Physico-Chimie Moléculaire

Publications

Miriam Navarrete-Miguel, Angelo Giussani, Mercedes Rubio, Martial Boggio-Pasqua, Antonio Carlos Borin, Daniel Roca-Sanjuán
Quantum-Chemistry Study of the Photophysical Properties of 4-Thiouracil and Comparisons with 2-Thiouracil. The journal of physical chemistry. A 128 (12) (2024)
Miriam Navarrete-Miguel, Angelo Giussani, Mercedes Rubio, Martial Boggio-Pasqua, Antonio Carlos Borin, Daniel Roca-Sanjuán
Quantum-Chemistry Study of the Photophysical Properties of 4-Thiouracil and Comparisons with 2-Thiouracil. The journal of physical chemistry. A 128 (12) (2024)
Miriam Navarrete-Miguel, Angelo Giussani, Mercedes Rubio, Martial Boggio-Pasqua, Antonio Carlos Borin, Daniel Roca-Sanjuán
Quantum-Chemistry Study of the Photophysical Properties of 4-Thiouracil and Comparisons with 2-Thiouracil. The journal of physical chemistry. A 128 (12) (2024)
Fábris Kossoski, Martial Boggio-Pasqua, Pierre-François Loos, Denis Jacquemin
Reference Energies for Double Excitations: Improvement and Extension. Journal of chemical theory and computation (2024)
Fábris Kossoski, Martial Boggio-Pasqua, Pierre-François Loos, Denis Jacquemin
Reference Energies for Double Excitations: Improvement and Extension. Journal of chemical theory and computation 20 (13) (2024)
Miriam Navarrete-Miguel, Angelo Giussani, Mercedes Rubio, Martial Boggio-Pasqua, Antonio Carlos Borin, Daniel Roca-Sanjuán
Quantum-Chemistry Study of the Photophysical Properties of 4-Thiouracil and Comparisons with 2-Thiouracil. The journal of physical chemistry. A (2024)
Elise Lognon, Rudraditya Sarkar, Marie-Catherine Heitz, Martial Boggio-Pasqua
Dihydropyrene/Cyclophanediene Photoswitching Mechanism Revisited with Spin-Flip Time-Dependent Density Functional Theory: Nature of the Photoisomerization Funnel at Stake! The journal of physical chemistry. A (2023)
Denis Jacquemin, Fábris Kossoski, Franck Gam, Martial Boggio-Pasqua, Pierre-François Loos
Reference Vertical Excitation Energies for Transition Metal Compounds. Journal of chemical theory and computation (2023)
Zakaria Ziani, Saioa Cobo, Frédérique Loiseau, Damien Jouvenot, Elise Lognon, Martial Boggio-Pasqua, Guy Royal
All Visible Light Photoswitch Based on the Dimethyldihydropyrene Unit Operating in Aqueous Solutions with High Quantum Yields. JACS Au 3 (1) (2022)
Zakaria Ziani, Saioa Cobo, Frédérique Loiseau, Damien Jouvenot, Elise Lognon, Martial Boggio-Pasqua, Guy Royal
All Visible Light Photoswitch Based on the Dimethyldihydropyrene Unit Operating in Aqueous Solutions with High Quantum Yields. JACS Au 3 (1) (2022)
Rudraditya Sarkar, Pierre-François Loos, Martial Boggio-Pasqua, Denis Jacquemin
Assessing the Performances of CASPT2 and NEVPT2 for Vertical Excitation Energies. Journal of chemical theory and computation 18 (4) (2022)
Rudraditya Sarkar, Marie-Catherine Heitz, Martial Boggio-Pasqua
Absorption band structure of the photochromic dimethyldihydropyrene/metacyclophanediene couple. Insight from vibronic coupling theory. The Journal of chemical physics 157 (22) (2022)
Enzo Monino, Martial Boggio-Pasqua, Anthony Scemama, Denis Jacquemin, Pierre-François Loos
Reference Energies for Cyclobutadiene: Automerization and Excited States. The journal of physical chemistry. A 126 (28) (2022)
Rudraditya Sarkar, Martial Boggio-Pasqua, Pierre-François Loos, Denis Jacquemin
Benchmarking TD-DFT and Wave Function Methods for Oscillator Strengths and Excited-State Dipole Moments. Journal of chemical theory and computation 17 (2) (2021)
Zakaria Ziani, Frédérique Loiseau, Elise Lognon, Martial Boggio-Pasqua, Christian Philouze, Saioa Cobo, Guy Royal
Synthesis of a Negative Photochrome with High Switching Quantum Yields and Capable of Singlet-Oxygen Production and Storage. Chemistry (Weinheim an der Bergstrasse, Germany) 27 (67) (2021)
Francesco Talotta, Leticia González, Martial Boggio-Pasqua
CASPT2 Potential Energy Curves for NO Dissociation in a Ruthenium Nitrosyl Complex. Molecules (Basel, Switzerland) 25 (11) (2020)
Pierre-François Loos, Anthony Scemama, Martial Boggio-Pasqua, Denis Jacquemin
Mountaineering Strategy to Excited States: Highly Accurate Energies and Benchmarks for Exotic Molecules and Radicals. Journal of chemical theory and computation 16 (6) (2020)
Pierre-François Loos, Filippo Lipparini, Martial Boggio-Pasqua, Anthony Scemama, Denis Jacquemin
A Mountaineering Strategy to Excited States: Highly Accurate Energies and Benchmarks for Medium Sized Molecules. Journal of chemical theory and computation 16 (3) (2020)
Margot Jacquet, Lucas M Uriarte, Frédéric Lafolet, Martial Boggio-Pasqua, Michel Sliwa, Frédérique Loiseau, Eric Saint-Aman, Saioa Cobo, Guy Royal
All Visible Light Switch Based on the Dimethyldihydropyrene Photochromic Core. The journal of physical chemistry letters 11 (7) (2020)
Dinesh G Patel, Martial Boggio-Pasqua, Travis B Mitchell, Ian M Walton, William R Quigley, Frank A Novak
Computational and Crystallographic Examination of Naphthoquinone Based Diarylethene Photochromes. Molecules (Basel, Switzerland) 25 (11) (2020)
Elise Lognon, Marie-Catherine Heitz, Assil Bakkar, Saioa Cobo, Frédérique Loiseau, Eric Saint-Aman, Guy Royal, Martial Boggio-Pasqua
Dependency of the Dimethyldihydropyrene Photochromic Properties on the Number of Pyridinium Electron-Withdrawing Groups. Chemphyschem : a European journal of chemical physics and physical chemistry 21 (14) (2020)
Francesco Talotta, Martial Boggio-Pasqua, Leticia González
Early Relaxation Dynamics in the Photoswitchable Complex trans-[RuCl(NO)(py)4 ]2. Chemistry (Weinheim an der Bergstrasse, Germany) 26 (50) (2020)
Nataliia Marchenko, Pascal G Lacroix, Valerii Bukhanko, Marine Tassé, Carine Duhayon, Martial Boggio-Pasqua, Isabelle Malfant
Multistep Photochemical Reactions of Polypyridine-Based Ruthenium Nitrosyl Complexes in Dimethylsulfoxide. Molecules (Basel, Switzerland) 25 (9) (2020)
Rudraditya Sarkar, Marie-Catherine Heitz, Guy Royal, Martial Boggio-Pasqua
Electronic Excited States and UV-Vis Absorption Spectra of the Dihydropyrene/Cyclophanediene Photochromic Couple: a Theoretical Investigation. The journal of physical chemistry. A 124 (8) (2020)
Juan Sanz García, Martial Boggio-Pasqua, Ilaria Ciofini, Marco Campetella
Excited state tracking during the relaxation of coordination compounds. Journal of computational chemistry 40 (14) (2019)
Pierre-François Loos, Martial Boggio-Pasqua, Anthony Scemama, Michel Caffarel, Denis Jacquemin
Reference Energies for Double Excitations. Journal of chemical theory and computation 15 (3) (2019)
Jordi Soler, Rudraditya Sarkar, Martial Boggio-Pasqua
Theoretical Rationalization of the Dual Photophysical Behavior of C60. The journal of physical chemistry. A 123 (9) (2019)
Amy A Cordones, Jae Hyuk Lee, Kiryong Hong, Hana Cho, Komal Garg, Martial Boggio-Pasqua, Jeffrey J Rack, Nils Huse, Robert W Schoenlein, Tae Kyu Kim
Transient metal-centered states mediate isomerization of a photochromic ruthenium-sulfoxide complex. Nature communications 9 (1) (2018)
Francesco Talotta, Jean-Louis Heully, Fabienne Alary, Isabelle M Dixon, Leticia González, Martial Boggio-Pasqua
Linkage Photoisomerization Mechanism in a Photochromic Ruthenium Nitrosyl Complex: New Insights from an MS-CASPT2 Study. Journal of chemical theory and computation 13 (12) (2017)
Margot Jacquet, Frédéric Lafolet, Saioa Cobo, Frédérique Loiseau, Assil Bakkar, Martial Boggio-Pasqua, Eric Saint-Aman, Guy Royal
Efficient Photoswitch System Combining a Dimethyldihydropyrene Pyridinium Core and Ruthenium(II) Bis-Terpyridine Entities. Inorganic chemistry 56 (8) (2017)
Juan Sanz García, Francesco Talotta, Fabienne Alary, Isabelle M Dixon, Jean-Louis Heully, Martial Boggio-Pasqua
A Theoretical Study of the N to O Linkage Photoisomerization Efficiency in a Series of Ruthenium Mononitrosyl Complexes. Molecules (Basel, Switzerland) 22 (10) (2017)
Andrew J Atkins, Francesco Talotta, Leon Freitag, Martial Boggio-Pasqua, Leticia González
Assessing Excited State Energy Gaps with Time-Dependent Density Functional Theory on Ru(II) Complexes. Journal of chemical theory and computation 13 (9) (2017)

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Publication Activity (10 Years)

Top Topics

Top Venues

Martial Boggio-Pasqua