| Amsterdam density functional EJ Baerends, J Autschbach, A Berces, FM Bickelhaupt, C Bo, PL de Boeij, ... Theoretical Chemistry, Vrije Universiteit, Amsterdam (URL http://www. scm. com), 2006 | 1644* | 2006 |
| Yambo: an ab initio tool for excited state calculations A Marini, C Hogan, M Grüning, D Varsano Computer Physics Communications 180 (8), 1392-1403, 2009 | 1241 | 2009 |
| Many-body perturbation theory calculations using the yambo code D Sangalli, A Ferretti, H Miranda, C Attaccalite, I Marri, E Cannuccia, ... Journal of Physics: Condensed Matter 31 (32), 325902, 2019 | 487 | 2019 |
| Shape corrections to exchange-correlation potentials by gradient-regulated seamless connection of model potentials for inner and outer region M Grüning, OV Gritsenko, SJA Van Gisbergen, EJ Baerends The Journal of Chemical Physics 114 (2), 652-660, 2001 | 429 | 2001 |
| Density functionals from many-body perturbation theory: The band gap for semiconductors and insulators M Grüning, A Marini, A Rubio The Journal of chemical physics 124 (15), 2006 | 245 | 2006 |
| Exciton-plasmon states in nanoscale materials: breakdown of the Tamm− Dancoff approximation M Gruning, A Marini, X Gonze Nano letters 9 (8), 2820-2824, 2009 | 182 | 2009 |
| Real-time approach to the optical properties of solids and nanostructures: Time-dependent Bethe-Salpeter equation C Attaccalite, M Grüning, A Marini Physical Review B—Condensed Matter and Materials Physics 84 (24), 245110, 2011 | 154 | 2011 |
| On the required shape corrections to the local density and generalized gradient approximations to the Kohn–Sham potentials for molecular response calculations of (hyper … M Grüning, OV Gritsenko, SJA Van Gisbergen, E Jan Baerends The Journal of chemical physics 116 (22), 9591-9601, 2002 | 143 | 2002 |
| Second harmonic generation in -BN and MoS monolayers: Role of electron-hole interaction M Grüning, C Attaccalite Physical Review B 89 (8), 081102, 2014 | 124 | 2014 |
| Exchange potential from the common energy denominator approximation for the Kohn–Sham Green’s function: Application to (hyper) polarizabilities of molecular chains M Grüning, OV Gritsenko, EJ Baerends The Journal of Chemical Physics 116 (15), 6435-6442, 2002 | 124 | 2002 |
| Theoretical Chemistry EJ Baerends, T Ziegler, J Autschbach, D Bashford, A Bérces, ... Vrije Universiteit, Amsterdam, The Netherlands https://www. scm. com, 2014 | 104 | 2014 |
| Nonlinear optics from an ab initio approach by means of the dynamical Berry phase: Application to second- and third-harmonic generation in semiconductors C Attaccalite, M Grüning Physical Review B—Condensed Matter and Materials Physics 88 (23), 235113, 2013 | 103 | 2013 |
| Exchange-correlation energy and potential as approximate functionals of occupied and virtual Kohn–Sham orbitals: Application to dissociating M Grüning, OV Gritsenko, EJ Baerends The Journal of chemical physics 118 (16), 7183-7192, 2003 | 93 | 2003 |
| Effect of spatial nonlocality on the density functional band gap M Grüning, A Marini, A Rubio Physical Review B—Condensed Matter and Materials Physics 74 (16), 161103, 2006 | 92 | 2006 |
| Spectroscopic Size and Thickness Metrics for Liquid-Exfoliated h-BN A Griffin, A Harvey, B Cunningham, D Scullion, T Tian, CJ Shih, ... Chemistry of Materials 30 (6), 1998-2005, 2018 | 91 | 2018 |
| Electronic properties of interfaces and defects from many‐body perturbation theory: Recent developments and applications M Giantomassi, M Stankovski, R Shaltaf, M Grüning, F Bruneval, P Rinke, ... physica status solidi (b) 248 (2), 275-289, 2011 | 91 | 2011 |
| The Failure of Generalized Gradient Approximations (GGAs) and Meta-GGAs for the Two-Center Three-Electron Bonds in He2+, (H2O)2+, and (NH3)2+ M Grüning, OV Gritsenko, SJA Van Gisbergen, EJ Baerends The Journal of Physical Chemistry A 105 (40), 9211-9218, 2001 | 91 | 2001 |
| Performance of density functionals for calculating barrier heights of chemical reactions relevant to astrophysics S Andersson, M Grüning The Journal of Physical Chemistry A 108 (37), 7621-7636, 2004 | 89 | 2004 |
| Comment on “Huge Excitonic Effects<? format?> in Layered Hexagonal Boron Nitride” L Wirtz, A Marini, M Grüning, C Attaccalite, G Kresse, A Rubio Physical review letters 100 (18), 189701, 2008 | 85 | 2008 |
| Density functional study of the photoactive yellow protein's chromophore A Sergi, M Grüning, M Ferrario, F Buda The Journal of Physical Chemistry B 105 (19), 4386-4391, 2001 | 81 | 2001 |
Claudio AttaccaliteCNRS, CINAM, Aix-Marseille UniversitéVerified email at cinam.univ-mrs.fr