| CP2K: An electronic structure and molecular dynamics software package-Quickstep: Efficient and accurate electronic structure calculations TD Kühne, M Iannuzzi, M Del Ben, VV Rybkin, P Seewald, F Stein, ... The Journal of Chemical Physics 152 (19), 2020 | 2627 | 2020 |
| Bulk liquid water at ambient temperature and pressure from MP2 theory M Del Ben, M Schönherr, J Hutter, J VandeVondele The journal of physical chemistry letters 4 (21), 3753-3759, 2013 | 173 | 2013 |
| Second-order Møller–Plesset perturbation theory in the condensed phase: An efficient and massively parallel Gaussian and plane waves approach M Del Ben, J Hutter, J VandeVondele Journal of chemical theory and computation 8 (11), 4177-4188, 2012 | 169 | 2012 |
| Electron correlation in the condensed phase from a resolution of identity approach based on the Gaussian and plane waves scheme M Del Ben, J Hutter, J VandeVondele Journal of chemical theory and computation 9 (6), 2654-2671, 2013 | 140 | 2013 |
| Density functional study on the morphology and photoabsorption of CdSe nanoclusters M Del Ben, RWA Havenith, R Broer, M Stener The Journal of Physical Chemistry C 115 (34), 16782-16796, 2011 | 134 | 2011 |
| GW in the Gaussian and Plane Waves Scheme with Application to Linear Acenes J Wilhelm, M Del Ben, J Hutter Journal of chemical theory and computation 12 (8), 3623-3635, 2016 | 126 | 2016 |
| Probing the structural and dynamical properties of liquid water with models including non-local electron correlation M Del Ben, J Hutter, J VandeVondele The Journal of chemical physics 143 (5), 2015 | 126 | 2015 |
| Large-scale cubic-scaling random phase approximation correlation energy calculations using a Gaussian basis J Wilhelm, P Seewald, M Del Ben, J Hutter Journal of chemical theory and computation 12 (12), 5851-5859, 2016 | 87 | 2016 |
| Forces and stress in second order Møller-Plesset perturbation theory for condensed phase systems within the resolution-of-identity Gaussian and plane waves approach M Del Ben, J Hutter, J VandeVondele The Journal of chemical physics 143 (10), 2015 | 73 | 2015 |
| Enabling simulation at the fifth rung of DFT: Large scale RPA calculations with excellent time to solution M Del Ben, O Schütt, T Wentz, P Messmer, J Hutter, J VandeVondele Computer Physics Communications 187, 120-129, 2015 | 65 | 2015 |
| Quantifying the hydration structure of sodium and potassium ions: taking additional steps on Jacob's Ladder TT Duignan, GK Schenter, JL Fulton, T Huthwelker, M Balasubramanian, ... Physical Chemistry Chemical Physics 22 (19), 10641-10652, 2020 | 58 | 2020 |
| Periodic MP2, RPA, and boundary condition assessment of hydrogen ordering in ice XV M Del Ben, J VandeVondele, B Slater The journal of physical chemistry letters 5 (23), 4122-4128, 2014 | 58 | 2014 |
| Reproducibility in G0W0 calculations for solids T Rangel, M Del Ben, D Varsano, G Antonius, F Bruneval, FH da Jornada, ... Computer Physics Communications 255, 107242, 2020 | 56 | 2020 |
| Large-scale GW calculations on pre-exascale HPC systems M Del Ben, FH da Jornada, A Canning, N Wichmann, K Raman, ... Computer Physics Communications 235, 187-195, 2019 | 48 | 2019 |
| Screening of excitons by organic cations in quasi-two-dimensional organic–inorganic lead-halide perovskites MR Filip, DY Qiu, M Del Ben, JB Neaton Nano letters 22 (12), 4870-4878, 2022 | 40 | 2022 |
| Accelerating large-scale excited-state GW calculations on leadership HPC systems M Del Ben, C Yang, Z Li, FH da Jornada, SG Louie, J Deslippe SC20: International Conference for High Performance Computing, Networking …, 2020 | 35 | 2020 |
| Static subspace approximation for the evaluation of quasiparticle energies within a sum-over-bands approach M Del Ben, FH da Jornada, G Antonius, T Rangel, SG Louie, J Deslippe, ... Physical Review B 99 (12), 125128, 2019 | 23 | 2019 |
| Outcomes of openMP hackathon: openMP application experiences with the offloading model (part II) B Chapman, B Pham, C Yang, C Daley, C Bertoni, D Kulkarni, ... OpenMP: Enabling Massive Node-Level Parallelism: 17th International Workshop …, 2021 | 14 | 2021 |
| Implementation of real‐time TDDFT for periodic systems in the open‐source PySCF software package K Hanasaki, ZA Ali, M Choi, M Del Ben, BM Wong Journal of Computational Chemistry 44 (9), 980-987, 2023 | 11 | 2023 |
| Quasiparticle energies and optical excitations of 3C-SiC divacancy from and plus Bethe-Salpeter equation calculations W Gao, FH da Jornada, M Del Ben, J Deslippe, SG Louie, ... Physical Review Materials 6 (3), 036201, 2022 | 11 | 2022 |