Screened hybrid density functionals applied to solids J Paier, M Marsman, K Hummer, G Kresse, IC Gerber, JG Ángyán The Journal of chemical physics 124 (15), 2006 | 2618 | 2006 |

Reproducibility in density functional theory calculations of solids K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ... Science 351 (6280), aad3000, 2016 | 1297 | 2016 |

The Perdew–Burke–Ernzerhof exchange-correlation functional applied to the G2-1 test set using a plane-wave basis set J Paier, R Hirschl, M Marsman, G Kresse The Journal of chemical physics 122 (23), 2005 | 992 | 2005 |

Accurate Quasiparticle Spectra from Self-Consistent *GW* Calculations with Vertex CorrectionsM Shishkin, M Marsman, G Kresse Physical review letters 99 (24), 246403, 2007 | 829 | 2007 |

Hybrid functionals applied to extended systems M Marsman, J Paier, A Stroppa, G Kresse Journal of Physics: Condensed Matter 20 (6), 064201, 2008 | 748 | 2008 |

Why does the B3LYP hybrid functional fail for metals? J Paier, M Marsman, G Kresse The Journal of chemical physics 127 (2), 2007 | 659 | 2007 |

Accurate surface and adsorption energies from many-body perturbation theory L Schimka, J Harl, A Stroppa, A Grüneis, M Marsman, F Mittendorfer, ... Nature materials 9 (9), 741-744, 2010 | 609 | 2010 |

Towards efficient band structure and effective mass calculations for III-V direct band-gap semiconductors YS Kim, M Marsman, G Kresse, F Tran, P Blaha Physical Review B—Condensed Matter and Materials Physics 82 (20), 205212, 2010 | 369 | 2010 |

Ground-state properties of multivalent manganese oxides: Density functional and hybrid density functional calculations C Franchini, R Podloucky, J Paier, M Marsman, G Kresse Physical Review B—Condensed Matter and Materials Physics 75 (19), 195128, 2007 | 366 | 2007 |

Dielectric properties and excitons for extended systems from hybrid functionals J Paier, M Marsman, G Kresse Physical Review B—Condensed Matter and Materials Physics 78 (12), 121201, 2008 | 325 | 2008 |

Electric control of magnetization and interplay between orbital ordering and ferroelectricity in a multiferroic metal–organic framework A Stroppa, P Jain, P Barone, M Marsman, JM Perez‐Mato, AK Cheetham, ... Angewandte Chemie International Edition 50 (26), 5847-5850, 2011 | 309 | 2011 |

Making the random phase approximation to electronic correlation accurate A Grüneis, M Marsman, J Harl, L Schimka, G Kresse The Journal of chemical physics 131 (15), 2009 | 300 | 2009 |

Self-consistent meta-generalized gradient approximation within the projector-augmented-wave method J Sun, M Marsman, GI Csonka, A Ruzsinszky, P Hao, YS Kim, G Kresse, ... Physical Review B—Condensed Matter and Materials Physics 84 (3), 035117, 2011 | 271 | 2011 |

Second-order Mřller–Plesset perturbation theory applied to extended systems. I. Within the projector-augmented-wave formalism using a plane wave basis set M Marsman, A Grüneis, J Paier, G Kresse The Journal of chemical physics 130 (18), 2009 | 253 | 2009 |

Second-order Mřller–Plesset perturbation theory applied to extended systems. II. Structural and energetic properties A Grüneis, M Marsman, G Kresse The Journal of Chemical Physics 133 (7), 2010 | 202 | 2010 |

Broken symmetries in the crystalline and magnetic structures of *γ*-ironM Marsman, J Hafner Physical Review B 66 (22), 224409, 2002 | 169 | 2002 |

Maximally localized Wannier functions in LaMnO3 within PBE+ U, hybrid functionals and partially self-consistent GW: an efficient route to construct ab initio tight-binding … C Franchini, R Kováčik, M Marsman, SS Murthy, J He, C Ederer, G Kresse Journal of Physics: Condensed Matter 24 (23), 235602, 2012 | 160 | 2012 |

Natural orbitals for wave function based correlated calculations using a plane wave basis set A Grüneis, GH Booth, M Marsman, J Spencer, A Alavi, G Kresse Journal of chemical theory and computation 7 (9), 2780-2785, 2011 | 152 | 2011 |

Structural and magnetic isomers of small Pd and Rh clusters: an ab initio density functional study T Futschek, M Marsman, J Hafner Journal of Physics: Condensed Matter 17 (38), 5927, 2005 | 148 | 2005 |

: A noncentrosymmetric BCS-like superconductor E Bauer, RT Khan, H Michor, E Royanian, A Grytsiv, ... Physical Review B—Condensed Matter and Materials Physics 80 (6), 064504, 2009 | 145 | 2009 |