Emmanuel Giner, PhD
Affiliations: | 2011-2014 | Physics | Université Toulouse III - Paul Sabatier, Toulouse, Occitanie, France |
| 2017- | Theoretical Chemistry | Sorbonne Université, Paris, France |
Area:
Theoretical Chemistry, PhysicsWebsite:
https://www.researchgate.net/profile/Emmanuel_GinerGoogle:
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Cross-listing: Physics Tree
Parents
Sign in to add mentor| Michel Caffarel | grad student | 2011-2014 | Université Toulouse III - Paul Sabatier | |
| (Méthodes d'interaction de configurations et Monte Carlo quantique : marier le meilleur des deux mondes) | ||||
| Anthony Scemama | grad student | 2011-2014 | Université Toulouse III - Paul Sabatier | |
| (Méthodes d'interaction de configurations et Monte Carlo quantique : marier le meilleur des deux mondes) | ||||
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Publications
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| Tenti L, Peeters S, Giner E, et al. (2024) Entanglement and Mutual Information in Molecules: Comparing Localized and Delocalized Orbitals. Journal of Chemical Theory and Computation. 20: 10861-10874 |
| Traore D, Adjoua O, Feniou C, et al. (2024) Shortcut to chemically accurate quantum computing via density-based basis-set correction. Communications Chemistry. 7: 269 |
| Ammar A, Scemama A, Loos PF, et al. (2024) Compactification of determinant expansions via transcorrelation. The Journal of Chemical Physics. 161 |
| Traore D, Toulouse J, Giner E. (2024) Accelerated basis-set convergence of coupled-cluster excitation energies using the density-based basis-set correction method. Faraday Discussions |
| Labat M, Giner E, Jeanmairet G. (2024) Coupling molecular density functional theory with converged selected configuration interaction methods to study excited states in aqueous solution. The Journal of Chemical Physics. 161 |
| Feniou C, Adjoua O, Claudon B, et al. (2024) Sparse Quantum State Preparation for Strongly Correlated Systems. The Journal of Physical Chemistry Letters. 3197-3205 |
| Heßelmann A, Giner E, Reinhardt P, et al. (2024) A density-fitting implementation of the density-based basis-set correction method. Journal of Computational Chemistry |
| Ferté A, Giner E, Taïeb R, et al. (2023) Unraveling the variational breakdown of core valence separation calculations: Diagnostic and cure to the over relaxation error of double core hole states. The Journal of Chemical Physics. 159 |
| Ammar A, Scemama A, Giner E. (2023) Transcorrelated selected configuration interaction in a bi-orthonormal basis and with a cheap three-body correlation factor. The Journal of Chemical Physics. 159 |
| Ammar A, Scemama A, Giner E. (2023) Biorthonormal Orbital Optimization with a Cheap Core-Electron-Free Three-Body Correlation Factor for Quantum Monte Carlo and Transcorrelation. Journal of Chemical Theory and Computation |