Concepedia
Statistics
Publications
21
Citations
519
H-Index
14
Active since
2017
Affiliations
University of Turin(Current)
University of Saskatchewan
Université de Lille
Institut des Sciences Analytiques et de Physico-Chimie pour l'Environnement et les Matériaux
Université de Pau et des Pays de l'Adour
Jacques K. Desmarais is an author at University of Turin specializing in natural sciences, physics, and density functional theory.
Publications per year
2017–2025
Graphene and graphene oxide as adsorbents for cadmium and lead heavy metals: A theoretical investigation
Sara M. Elgengehi, Sabry El‐Taher, Mahmoud A. A. Ibrahim et al. · Applied Surface Science · 2019 · 73 citations
Natural Sciences, Materials Engineering, Materials Science +15
Generalization of the periodic LCAO approach in the CRYSTAL code to g-type orbitals
Jacques K. Desmarais, Alessandro Erba, Roberto Dovesi · Theoretical Chemistry Accounts · 2018 · 44 citations
Natural Sciences, Chemistry, Computational Chemistry +15
Spin-orbit coupling in periodic systems with broken time-reversal symmetry: Formal and computational aspects
Jacques K. Desmarais, Jean‐Pierre Flament, Alessandro Erba · Physical review. B./Physical review. B · 2020 · 40 citations · Full text
Natural Sciences, Materials Science, Physics +17
Spin–orbit coupling from a two-component self-consistent approach. II. Non-collinear density functional theories
Jacques K. Desmarais, Stanislav Komorovský, Jean‐Pierre Flament et al. · The Journal of Chemical Physics · 2021 · 39 citations · Full text
Natural Sciences, Chemistry, Physics +17
Spin-orbit coupling from a two-component self-consistent approach. I. Generalized Hartree-Fock theory
Jacques K. Desmarais, Jean‐Pierre Flament, Alessandro Erba · The Journal of Chemical Physics · 2019 · 33 citations · Full text
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