Jacques K Desmarais

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 11

Top Topics

Oxide Nanoparticles

Room Temperature

Molecular Dynamics

Top Venues

Journal of chemical theory and computation

The journal of physical chemistry letters

The Journal of chemical physics

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

Publications

Alberto Boccuni, Bárbara Maria Teixeira Costa Peluzo, Filippo Bodo, Giacomo Ambrogio, Jefferson Maul, Davide Mitoli, Giovanni Vignale, Stefano Pittalis, Elfi Kraka, Jacques K Desmarais, Alessandro Erba
Unveiling the Role of Spin Currents on the Giant Rashba Splitting in Single-Layer WSe 2 . The journal of physical chemistry letters (2024)
Alberto Boccuni, Bárbara Maria Teixeira Costa Peluzo, Filippo Bodo, Giacomo Ambrogio, Jefferson Maul, Davide Mitoli, Giovanni Vignale, Stefano Pittalis, Elfi Kraka, Jacques K Desmarais, Alessandro Erba
Unveiling the Role of Spin Currents on the Giant Rashba Splitting in Single-Layer WSe 2 . The journal of physical chemistry letters 15 (29) (2024)
Alberto Boccuni, Bárbara Maria Teixeira Costa Peluzo, Filippo Bodo, Giacomo Ambrogio, Jefferson Maul, Davide Mitoli, Giovanni Vignale, Stefano Pittalis, Elfi Kraka, Jacques K Desmarais, Alessandro Erba
Unveiling the Role of Spin Currents on the Giant Rashba Splitting in Single-Layer WSe 2 . The journal of physical chemistry letters 15 (29) (2024)
Jacques K Desmarais, Alberto Boccuni, Jean-Pierre Flament, Bernard Kirtman, Alessandro Erba
Perturbation Theory Treatment of Spin-Orbit Coupling. III: Coupled Perturbed Method for Solids. Journal of chemical theory and computation (2023)
Jacques K Desmarais, Alessandro De Frenza, Alessandro Erba
Efficient calculation of derivatives of integrals in a basis of non-separable Gaussians. The Journal of chemical physics 158 (15) (2023)
Jacques K Desmarais, Alessandro De Frenza, Alessandro Erba
Efficient calculation of derivatives of integrals in a basis of non-separable Gaussians. The Journal of chemical physics 158 (15) (2023)
Jacques K Desmarais, Alessandro De Frenza, Alessandro Erba
Efficient calculation of derivatives of integrals in a basis of non-separable Gaussians. The Journal of chemical physics 158 (15) (2023)
Alessandro Erba, Jacques K Desmarais, Silvia Maria Casassa, Bartolomeo Civalleri, Lorenzo Donà, Ian J Bush, Barry Searle, Lorenzo Maschio, Loredana Edith-Daga, Alessandro Cossard, Chiara Ribaldone, Eleonora Ascrizzi, Naiara Leticia Marana, Jean-Pierre Flament, Bernard Kirtman
CRYSTAL23: A Program for Computational Solid State Physics and Chemistry. Journal of chemical theory and computation (2022)
Alessandro Erba, Jacques K Desmarais, Silvia Maria Casassa, Bartolomeo Civalleri, Lorenzo Donà, Ian J Bush, Barry Searle, Lorenzo Maschio, Loredana Edith-Daga, Alessandro Cossard, Chiara Ribaldone, Eleonora Ascrizzi, Naiara Leticia Marana, Jean-Pierre Flament, Bernard Kirtman
CRYSTAL23: A Program for Computational Solid State Physics and Chemistry. Journal of chemical theory and computation (2022)
Jacques K Desmarais, Alessandro Erba, Jean-Pierre Flament, Bernard Kirtman
Perturbation Theory Treatment of Spin-Orbit Coupling II: A Coupled Perturbed Kohn-Sham Method. Journal of chemical theory and computation 17 (8) (2021)
Jacques K Desmarais, Alessandro Erba, Jean-Pierre Flament, Bernard Kirtman
Perturbation Theory Treatment of Spin-Orbit Coupling, Part I: Double Perturbation Theory Based on a Single-Reference Initial Approximation. Journal of chemical theory and computation 17 (8) (2021)