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Theoretical and Computational Chemistry

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Martial Boggio-Pasqua

3 results in Authors: Martial Boggio-Pasqua

Theoretical and Computational Chemistry

A Mountaineering Strategy to Excited States: Highly-Accurate Energies and Benchmarks for Medium Size Molecules

Pierre-Francois Loos, Filippo Lipparini, Martial Boggio-Pasqua, Anthony Scemama, Denis Jacquemin

Version 1 posted 19 December 2019

374

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Theoretical and Computational Chemistry

Unravelling the Photodissociative Mechanism of CO-Release in Re(I) Tricarbonyl Complex Using Density Functional Theory

Prashant Kumar, Martial Boggio-Pasqua, Isabelle Dixon

Version 1 posted 28 November 2024

165

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Theoretical and Computational Chemistry

Excited State Tracking During the Relaxation of Coordination Compounds

Juan Sanz García, Martial Boggio-Pasqua, Ilaria Ciofini, Marco Campetella

Version 1 posted 12 December 2018

949

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