Publications by authors named "Pascal Pernot"

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A new method for in vivo assessment of corneal transparency using spectral-domain OCT.
Maëlle Vilbert, Romain Bocheux, Cristina Georgeon, Vincent Borderie, Pascal Pernot

PLoS One· November 2023

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A Novel Pump-Pump-Probe Resonance Raman Approach Featuring Light-Induced Charge Accumulation on a Model Photosystem.
Daniel H Cruz Neto, Juan Soto, Nishith Maity, Christophe Lefumeux, Thai Nguyen, Pascal Pernot

J Phys Chem Lett· May 2023

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DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science.
Andrew M Teale, Trygve Helgaker, Andreas Savin, Carlo Adamo, Bálint Aradi, Pascal Pernot

Phys Chem Chem Phys· December 2022

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Prediction uncertainty validation for computational chemists.
Pascal Pernot

J Chem Phys· October 2022

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The long road to calibrated prediction uncertainty in computational chemistry.
Pascal Pernot

J Chem Phys· March 2022

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Modulation of the Directionality of Hole Transfer between the Base and the Sugar-Phosphate Backbone in DNA with the Number of Sulfur Atoms in the Phosphate Group.
Sergey A Denisov, Samuel Ward, Viacheslav Shcherbakov, Alexander D Stark, Renata Kaczmarek, Pascal Pernot

J Phys Chem B· January 2022

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Erratum: Probabilistic performance estimators for computational chemistry methods: Systematic improvement probability and ranking probability matrix. I. Theory [J. Chem. Phys. 152, 164108 (2020)].
Pascal Pernot, Andreas Savin

J Chem Phys· October 2020

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One Way Traffic: Base-to-Backbone Hole Transfer in Nucleoside Phosphorodithioate.
Renata Kaczmarek, Samuel Ward, Dipra Debnath, Taisiya Jacobs, Alexander D Stark, Pascal Pernot

Chemistry· August 2020

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One Way Traffic: Base-to-Backbone Hole Transfer in Nucleoside Phosphorodithioate.
Renata Kaczmarek, Samuel Ward, Dipra Debnath, Taisiya Jacobs, Alexander D Stark, Pascal Pernot

Chemistry· August 2020

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Probabilistic performance estimators for computational chemistry methods: Systematic improvement probability and ranking probability matrix. I. Theory.
Pascal Pernot, Andreas Savin

J Chem Phys· April 2020

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Probabilistic performance estimators for computational chemistry methods: Systematic improvement probability and ranking probability matrix. II. Applications.
Pascal Pernot, Andreas Savin

J Chem Phys· April 2020

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Quantitative measures of corneal transparency, derived from objective analysis of depth-resolved corneal images, demonstrated with full-field optical coherence tomographic microscopy.
Romain Bocheux, Pascal Pernot, Vincent Borderie, Karsten Plamann, Kristina Irsch

PLoS One· March 2020

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Mechanism of (SCN) Formation and Decay in Neutral and Basic KSCN Solution under Irradiation from a Pico- to Microsecond Range.
Furong Wang, Pascal Pernot, Jean-Louis Marignier, Pierre Archirel, Mehran Mostafavi

J Phys Chem B· August 2019

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Erratum: "Probabilistic performance estimators for computational chemistry methods: The empirical cumulative distribution function of absolute errors" [J. Chem. Phys. 148, 241707 (2018)].
Pascal Pernot, Andreas Savin

J Chem Phys· June 2019

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Ultrafast Electron Attachment and Hole Transfer Following Ionizing Radiation of Aqueous Uridine Monophosphate.
Jun Ma, Sergey A Denisov, Jean-Louis Marignier, Pascal Pernot, Amitava Adhikary

J Phys Chem Lett· September 2018

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Picosecond Pulse Radiolysis Study on the Radiation-Induced Reactions in Neat Tributyl Phosphate.
Furong Wang, Gregory P Horne, Pascal Pernot, Pierre Archirel, Mehran Mostafavi

J Phys Chem B· July 2018

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Probabilistic performance estimators for computational chemistry methods: The empirical cumulative distribution function of absolute errors.
Pascal Pernot, Andreas Savin

J Chem Phys· June 2018

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Direct observation of the oxidation of DNA bases by phosphate radicals formed under radiation: a model of the backbone-to-base hole transfer.
Jun Ma, Jean-Louis Marignier, Pascal Pernot, Chantal Houée-Levin, Anil Kumar

Phys Chem Chem Phys· May 2018

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Oxygen anion (O ) and hydroxide anion (HO ) reactivity with a series of old and new refrigerants.
Clotilde Le Vot, Joël Lemaire, Pascal Pernot, Michel Heninger, Hélène Mestdagh

J Mass Spectrom· April 2018

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The parameter uncertainty inflation fallacy.
Pascal Pernot

J Chem Phys· September 2017

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Observation and Simulation of Transient Anion Oligomers (LiClO) (n = 1-4) in Diethyl Carbonate LiClO Solutions.
Furong Wang, Pascal Pernot, Pierre Archirel, Uli Schmidhammer, Daniel Ortiz

J Phys Chem B· August 2017

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Effect of the solvation state of electron in dissociative electron attachment reaction in aqueous solutions.
Furong Wang, Pierre Archirel, Yusa Muroya, Shinichi Yamashita, Pascal Pernot

Phys Chem Chem Phys· August 2017

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When does a functional correctly describe both the structure and the energy of the transition state?
Neil Qiang Su, Pascal Pernot, Xin Xu, Andreas Savin

J Mol Model· February 2017

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Molecular Isomer Identification of Titan's Tholins Organic Aerosols by Photoelectron/Photoion Coincidence Spectroscopy Coupled to VUV Synchrotron Radiation.
Barbara Cunha de Miranda, Gustavo A Garcia, François Gaie-Levrel, Ahmed Mahjoub, Thomas Gautier, Pascal Pernot

J Phys Chem A· August 2016

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Energetics of Photoinduced Charge Migration within the Tryptophan Tetrad of an Animal (6-4) Photolyase.
Fabien Cailliez, Pavel Müller, Thiago Firmino, Pascal Pernot, Aurélien de la Lande

J Am Chem Soc· February 2016

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