Geoffrey Pourtois

Publication Activity (10 Years)

Years Active: 2022-2024
Publications (10 Years): 10

Top Topics

Electron Transfer

Machine Learning

Molecular Dynamics

Top Venues

The journal of physical chemistry letters

Journal of chemical information and modeling

ACS nanoscience Au

Molecules (Basel, Switzerland)

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

Publications

Laura Galleni, Arne Meulemans, Faegheh S Sajjadian, Dhirendra P Singh, Shikhar Arvind, Kevin M Dorney, Thierry Conard, Gabriele D'Avino, Geoffrey Pourtois, Daniel Escudero, Michiel J van Setten
Peak Broadening in Photoelectron Spectroscopy of Amorphous Polymers: The Leading Role of the Electrostatic Landscape. The journal of physical chemistry letters (2024)
Laura Galleni, Arne Meulemans, Faegheh S Sajjadian, Dhirendra P Singh, Shikhar Arvind, Kevin M Dorney, Thierry Conard, Gabriele D'Avino, Geoffrey Pourtois, Daniel Escudero, Michiel J van Setten
Peak Broadening in Photoelectron Spectroscopy of Amorphous Polymers: The Leading Role of the Electrostatic Landscape. The journal of physical chemistry letters 15 (3) (2024)
Esteban A Marques, Stefan De Gendt, Geoffrey Pourtois, Michiel J van Setten
Benchmarking First-Principles Reaction Equilibrium Composition Prediction. Molecules (Basel, Switzerland) 28 (9) (2023)
Esteban A Marques, Stefan de Gendt, Geoffrey Pourtois, Michiel J van Setten
Improving Accuracy and Transferability of Machine Learning Chemical Activation Energies by Adding Electronic Structure Information. Journal of chemical information and modeling (2023)
Esteban A Marques, Stefan De Gendt, Geoffrey Pourtois, Michiel J van Setten
Benchmarking First-Principles Reaction Equilibrium Composition Prediction. Molecules (Basel, Switzerland) 28 (9) (2023)
Esteban A Marques, Stefan de Gendt, Geoffrey Pourtois, Michiel J van Setten
Improving Accuracy and Transferability of Machine Learning Chemical Activation Energies by Adding Electronic Structure Information. Journal of chemical information and modeling 63 (5) (2023)
Esteban A Marques, Stefan de Gendt, Geoffrey Pourtois, Michiel J van Setten
Improving Accuracy and Transferability of Machine Learning Chemical Activation Energies by Adding Electronic Structure Information. Journal of chemical information and modeling 63 (5) (2023)
Laura Galleni, Faegheh S Sajjadian, Thierry Conard, Daniel Escudero, Geoffrey Pourtois, Michiel J van Setten
Modeling X-ray Photoelectron Spectroscopy of Macromolecules Using GW . The journal of physical chemistry letters 13 (37) (2022)
Yu Lei, Tianyi Zhang, Yu-Chuan Lin, Tomotaroh Granzier-Nakajima, George Bepete, Dorota Anna Kowalczyk, Zhong Lin, Da Zhou, Thomas F Schranghamer, Akhil Dodda, Amritanand Sebastian, Yifeng Chen, Yuanyue Liu, Geoffrey Pourtois, Thomas J Kempa, Bruno Schuler, Mark T Edmonds, Su Ying Quek, Ursula Wurstbauer, Stephen M Wu, Nicholas Robert Glavin, Saptarshi Das, Saroj Prasad Dash, Joan Marie Redwing, Joshua A Robinson, Mauricio Terrones
Graphene and Beyond: Recent Advances in Two-Dimensional Materials Synthesis, Properties, and Devices. ACS nanoscience Au 2 (6) (2022)
Yu Lei, Tianyi Zhang, Yu-Chuan Lin, Tomotaroh Granzier-Nakajima, George Bepete, Dorota Anna Kowalczyk, Zhong Lin, Da Zhou, Thomas F Schranghamer, Akhil Dodda, Amritanand Sebastian, Yifeng Chen, Yuanyue Liu, Geoffrey Pourtois, Thomas J Kempa, Bruno Schuler, Mark T Edmonds, Su Ying Quek, Ursula Wurstbauer, Stephen M Wu, Nicholas Robert Glavin, Saptarshi Das, Saroj Prasad Dash, Joan Marie Redwing, Joshua A Robinson, Mauricio Terrones
Graphene and Beyond: Recent Advances in Two-Dimensional Materials Synthesis, Properties, and Devices. ACS nanoscience Au 2 (6) (2022)