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), 194103, 2020 | 630 | 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 | 149 | 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 | 138 | 2012 |

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 | 122 | 2011 |

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 | 114 | 2013 |

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), 054506, 2015 | 95 | 2015 |

*GW* in the Gaussian and Plane Waves Scheme with Application to Linear AcenesJ Wilhelm, M Del Ben, J Hutter Journal of Chemical Theory and Computation 12 (8), 3623-3635, 2016 | 85 | 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), 102803, 2015 | 61 | 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 | 58 | 2016 |

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 | 52 | 2014 |

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 | 45 | 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 | 28 | 2020 |

Reproducibility in G0W0 calculations for solids T Rangel, M Del Ben, D Varsano, G Antonius, F Bruneval, H Felipe, ... Computer Physics Communications 255, 107242, 2020 | 22 | 2020 |

Large-scale GW calculations on pre-exascale HPC systems M Del Ben, H Felipe, A Canning, N Wichmann, K Raman, R Sasanka, ... Computer Physics Communications 235, 187-195, 2019 | 22 | 2019 |

Accelerating large-scale excited-state GW calculations on leadership HPC systems M Del Ben, C Yang, Z Li, H Felipe, SG Louie, J Deslippe SC20: International Conference for High Performance Computing, Networking …, 2020 | 12 | 2020 |

Static subspace approximation for the evaluation of quasiparticle energies within a sum-over-bands approach M Del Ben, H Felipe, G Antonius, T Rangel, SG Louie, J Deslippe, ... Physical Review B 99 (12), 125128, 2019 | 7 | 2019 |

Picosecond Absorption Spectroscopy of Excited States in with and without Dopant and Codopant P Li, S Gridin, KB Ucer, RT Williams, M Del Ben, A Canning, F Moretti, ... Physical Review Applied 12 (1), 014035, 2019 | 5 | 2019 |

Accelerating large-scale GW calculations on hybrid GPU-CPU systems M Del Ben, C Yang, S Louie, J Deslippe Bulletin of the American Physical Society 65, 2020 | 3 | 2020 |

MP2-and RPA-Based Ab Initio Molecular Dynamics and Monte Carlo Sampling J Hutter, J Wilhelm, VV Rybkin, M Del Ben, J VandeVondele Handbook of Materials Modeling: Methods: Theory and Modeling, 523-543, 2020 | 3 | 2020 |

Outcomes of OpenMP Hackathon: OpenMP Application Experiences with the Offloading Mode S Pophale, D Oryspayev, B Chapman, B Pham, C Yang, C Daley, ... Brookhaven National Lab.(BNL), Upton, NY (United States), 2021 | 2 | 2021 |