Ab initio molecular simulations with numeric atom-centered orbitals V Blum, R Gehrke, F Hanke, P Havu, V Havu, X Ren, K Reuter, ... Computer Physics Communications 180 (11), 2175-2196, 2009 | 2835 | 2009 |
Resolution-of-identity approach to Hartree–Fock, hybrid density functionals, RPA, MP2 and GW with numeric atom-centered orbital basis functions X Ren, P Rinke, V Blum, J Wieferink, A Tkatchenko, A Sanfilippo, K Reuter, ... New Journal of Physics 14 (5), 053020, 2012 | 755 | 2012 |
Random-phase approximation and its applications in computational chemistry and materials science X Ren, P Rinke, C Joas, M Scheffler Journal of Materials Science 47, 7447-7471, 2012 | 621 | 2012 |
Full orbital calculation scheme for materials with strongly correlated electrons VI Anisimov, DE Kondakov, AV Kozhevnikov, IA Nekrasov, ZV Pchelkina, ... Physical Review B—Condensed Matter and Materials Physics 71 (12), 125119, 2005 | 384 | 2005 |
GW100: Benchmarking G0W0 for Molecular Systems MJ Van Setten, F Caruso, S Sharifzadeh, X Ren, M Scheffler, F Liu, ... Journal of chemical theory and computation 11 (12), 5665-5687, 2015 | 362 | 2015 |
Beyond the Random-Phase Approximation for the Electron Correlation Energy:<? format?> The Importance of Single Excitations X Ren, A Tkatchenko, P Rinke, M Scheffler Physical review letters 106 (15), 153003, 2011 | 262 | 2011 |
Unified description of ground and excited states of finite systems: The self-consistent approach F Caruso, P Rinke, X Ren, M Scheffler, A Rubio Physical Review B—Condensed Matter and Materials Physics 86 (8), 081102, 2012 | 226 | 2012 |
Benchmark of methods for azabenzenes N Marom, F Caruso, X Ren, OT Hofmann, T Körzdörfer, JR Chelikowsky, ... Physical Review B—Condensed Matter and Materials Physics 86 (24), 245127, 2012 | 211 | 2012 |
Structure and energetics of benzene adsorbed on transition-metal surfaces: density-functional theory with van der Waals interactions including collective substrate response W Liu, VG Ruiz, GX Zhang, B Santra, X Ren, M Scheffler, A Tkatchenko New Journal of Physics 15 (5), 053046, 2013 | 200 | 2013 |
Exploring the random phase approximation: Application to CO adsorbed on Cu (111) X Ren, P Rinke, M Scheffler Physical Review B—Condensed Matter and Materials Physics 80 (4), 045402, 2009 | 194 | 2009 |
Self-consistent : All-electron implementation with localized basis functions F Caruso, P Rinke, X Ren, A Rubio, M Scheffler Physical Review B—Condensed Matter and Materials Physics 88 (7), 075105, 2013 | 192 | 2013 |
Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules III: A Benchmark of GW Methods JW Knight, X Wang, L Gallandi, O Dolgounitcheva, X Ren, JV Ortiz, ... Journal of chemical theory and computation 12 (2), 615-626, 2016 | 189 | 2016 |
Hybrid functionals for large periodic systems in an all-electron, numeric atom-centered basis framework SV Levchenko, X Ren, J Wieferink, R Johanni, P Rinke, V Blum, ... Computer Physics Communications 192, 60-69, 2015 | 184 | 2015 |
Assessment of correlation energies based on the random-phase approximation J Paier, X Ren, P Rinke, GE Scuseria, A Grüneis, G Kresse, M Scheffler New Journal of Physics 14 (4), 043002, 2012 | 177 | 2012 |
Renormalized second-order perturbation theory for the electron correlation energy: Concept, implementation, and benchmarks X Ren, P Rinke, GE Scuseria, M Scheffler Physical Review B—Condensed Matter and Materials Physics 88 (3), 035120, 2013 | 154 | 2013 |
computation of the electronic spectrum of NiO X Ren, I Leonov, G Keller, M Kollar, I Nekrasov, D Vollhardt Physical Review B—Condensed Matter and Materials Physics 74 (19), 195114, 2006 | 152 | 2006 |
Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory AC Ihrig, J Wieferink, IY Zhang, M Ropo, X Ren, P Rinke, M Scheffler, ... New Journal of Physics 17 (9), 093020, 2015 | 135 | 2015 |
Electronic structure of copper phthalocyanine from calculations N Marom, X Ren, JE Moussa, JR Chelikowsky, L Kronik Physical Review B—Condensed Matter and Materials Physics 84 (19), 195143, 2011 | 126 | 2011 |
Numeric atom-centered-orbital basis sets with valence-correlation consistency from H to Ar IY Zhang, X Ren, P Rinke, V Blum, M Scheffler New Journal of Physics 15 (12), 123033, 2013 | 118 | 2013 |
Bond breaking and bond formation: How electron correlation is captured in many-body perturbation theory and density-functional theory F Caruso, DR Rohr, M Hellgren, X Ren, P Rinke, A Rubio, M Scheffler physical review letters 110 (14), 146403, 2013 | 108 | 2013 |