Dusson, Geneviève

1. Atomic Permutationally Invariant Polynomials for Fitting Molecular Force Fields
   2020/10/23 by Allen, Alice, Csányi, Gábor, Dusson, Geneviève +1 · 2 citations
   #Chemical Physics (physics.chem-ph) #Computational Physics (physics.comp-ph) #FOS: Physical sciences
2. Polynomial Approximation of Symmetric Functions
   2021/09/30 by Bachmayr, Markus, Dusson, Geneviève, Ortner, Christoph +1 · 2 citations
   #FOS: Mathematics #Numerical Analysis (math.NA)
3. Discretization error cancellation in electronic structure calculation: a quantitative study
   2017/01/17 by Cancès, Eric, Dusson, Geneviève · 1 citation
   #Computational Physics (physics.comp-ph) #FOS: Mathematics #FOS: Physical sciences #Materials Science (cond-mat.mtrl-sci) #Numerical Analysis (math.NA)
4. Grassmann extrapolation of density matrices for Born-Oppenheimer molecular dynamics
   2021/07/28 by Polack, Etienne, Dusson, Geneviève, Stamm, Benjamin +1 · 1 citation
   #Chemical Physics (physics.chem-ph) #FOS: Physical sciences
5. A Quasi Time-Reversible scheme based on density matrix extrapolation on the Grassmann manifold for Born-Oppenheimer Molecular Dynamics
   2023/07/11 by Pes, Federica, Polack, Ètienne, Mazzeo, Patrizia +3 · 1 citation
   #Chemical Physics (physics.chem-ph) #FOS: Physical sciences #Soft Condensed Matter (cond-mat.soft)
6. Fully guaranteed and computable error bounds on the energy for periodic Kohn-Sham equations with convex density functionals
   2024/09/18 by Bordignon, Andrea, Dusson, Geneviève, Cancès, Éric +3 · 1 citation
   #FOS: Mathematics #Numerical Analysis (math.NA)