| Recent developments in the ABINIT software package X Gonze, F Jollet, FA Araujo, D Adams, B Amadon, T Applencourt, ... Computer Physics Communications 205, 106-131, 2016 | 876 | 2016 |
| Efficient spectral computation of the stationary states of rotating Bose–Einstein condensates by preconditioned nonlinear conjugate gradient methods X Antoine, A Levitt, Q Tang Journal of Computational Physics 343, 92-109, 2017 | 100 | 2017 |
| Convergence analysis of direct minimization and self-consistent iterations E Cancès, G Kemlin, A Levitt SIAM Journal on Matrix Analysis and Applications 42 (1), 243-274, 2021 | 57 | 2021 |
| Truncated Conjugated Gradient (TCG): an optimal strategy for the analytical evaluation of the many-body polarization energy and forces in molecular simulations F Aviat, A Levitt, B Stamm, Y Maday, P Ren, JW Ponder, L Lagardere, ... Journal of Chemical Theory and Computation, 2015 | 50* | 2015 |
| DFTK: A Julian approach for simulating electrons in solids MF Herbst, A Levitt, E Cancès Proceedings of the JuliaCon Conferences 3 (26), 69, 2021 | 41 | 2021 |
| Robust determination of maximally localized Wannier functions É Cancès, A Levitt, G Panati, G Stoltz Physical Review B 95 (7), 075114, 2017 | 40 | 2017 |
| Parallel eigensolvers in plane-wave density functional theory A Levitt, M Torrent Computer Physics Communications 187, 98-105, 2015 | 38 | 2015 |
| Convergence of gradient-based algorithms for the Hartree-Fock equations A Levitt ESAIM: Mathematical Modelling and Numerical Analysis-Modélisation …, 2012 | 35 | 2012 |
| Variational formulation for Wannier functions with entangled band structure A Damle, A Levitt, L Lin Multiscale Modeling & Simulation 17 (1), 167-191, 2019 | 28 | 2019 |
| Hypocoercivity with Schur complements É Bernard, M Fathi, A Levitt, G Stoltz Annales Henri Lebesgue 5, 523-557, 2022 | 27 | 2022 |
| Black-box inhomogeneous preconditioning for self-consistent field iterations in density functional theory MF Herbst, A Levitt Journal of Physics: Condensed Matter 33 (8), 085503, 2020 | 24 | 2020 |
| Numerical quadrature in the Brillouin zone for periodic Schrödinger operators É Cancès, V Ehrlacher, D Gontier, A Levitt, D Lombardi Numerische Mathematik 144, 479-526, 2020 | 22 | 2020 |
| Screening in the Finite-Temperature Reduced Hartree–Fock Model A Levitt Archive for Rational Mechanics and Analysis 238 (2), 901-927, 2020 | 21 | 2020 |
| Convergence and Cycling in Walker-type Saddle Search Algorithms A Levitt, C Ortner SIAM Journal on Numerical Analysis 55 (5), 2204-2227, 2017 | 20 | 2017 |
| A posteriori error estimation for the non-self-consistent Kohn–Sham equations MF Herbst, A Levitt, E Cancès Faraday Discussions 224, 227-246, 2020 | 14 | 2020 |
| Best constants in Lieb-Thirring inequalities: a numerical investigation A Levitt Journal of Spectral Theory 4 (1), 153-175, 2014 | 12 | 2014 |
| initio canonical sampling based on variational inference A Castellano, F Bottin, J Bouchet, A Levitt, G Stoltz Physical Review B 106 (16), L161110, 2022 | 11 | 2022 |
| Localised Wannier functions in metallic systems HD Cornean, D Gontier, A Levitt, D Monaco Annales Henri Poincaré 20, 1367-1391, 2019 | 11 | 2019 |
| A robust and efficient line search for self-consistent field iterations MF Herbst, A Levitt Journal of Computational Physics 459, 111127, 2022 | 9 | 2022 |
| Finite-size effects in response functions of molecular systems MS Dupuy, A Levitt The SMAI Journal of computational mathematics 8, 273-294, 2022 | 9 | 2022 |
