Michiel J. van Setten

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Gian-Marco RignaneseDirecteur de Recherches F.R.S.-FNRS / Professeur UCLouvainVerifisert e-postadresse på uclouvain.be
Geert BrocksProfessor of physics, University of Twente, Enschede, and Eindhoven University of Technology.Verifisert e-postadresse på utwente.nl
Xavier GonzeProfessor of Computational Material Science (UCLouvain, Belgium)Verifisert e-postadresse på uclouvain.be
Matteo GiantomassiUniversité catholique de LouvainVerifisert e-postadresse på uclouvain.be
Gouri Sankar KarVP R&D, IMEC BelgiumVerifisert e-postadresse på imec.be
Gilles de WijsUD Radboud Universiteit, The NetherlandsVerifisert e-postadresse på science.ru.nl
Attilio BelmonteProgram Manager, imecVerifisert e-postadresse på imec.be
Adrian ChasinimecVerifisert e-postadresse på imec.be
Subhali SubhechhaimecVerifisert e-postadresse på imec.be
H.F.W. DekkersimecVerifisert e-postadresse på imec.be
Ferdinand EversInstitute of Theoretical Physics, University of RegensburgVerifisert e-postadresse på ur.de
geoffrey pourtoisimecVerifisert e-postadresse på imec.be
Geoffroy HautierDartmouth CollegeVerifisert e-postadresse på dartmouth.edu
Maximilian FichtnerExecutive Director, Helmholtz-Institute Ulm (HIU)Verifisert e-postadresse på kit.edu
Lieve G TeugelsCMP Process Engineer, Meta Ireland Reality Labs, IrelandVerifisert e-postadresse på fb.com
Harinarayanan PuliyalilIMEC, Kapeldreef 75, 3001 Leuven, BelgiumVerifisert e-postadresse på ki.si
Patrick RinkeProfessor at Technical University Munich, GermanyVerifisert e-postadresse på tum.de
Steven G. LouieProfessor of Physics, University of California at BerkeleyVerifisert e-postadresse på berkeley.edu
Jack DeslippeLawrence Berkeley National LaboratoryVerifisert e-postadresse på lbl.gov
Jeffrey B. NeatonUniversity of California, Berkeley & Lawrence Berkeley National LaboratoryVerifisert e-postadresse på berkeley.edu

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Michiel J. van Setten

principal member of technical staf at IMEC

Verifisert e-postadresse på imec.be - Startside

Many body perturbation theory density functional theory


Tittel Sorter etter sitater Sorter etter år Sorter etter tittel	Sitert av Sitert av	År
The PseudoDojo: Training and grading a 85 element optimized norm-conserving pseudopotential table MJ van Setten, M Giantomassi, E Bousquet, MJ Verstraete, DR Hamann, ... Computer Physics Communications 226, 39-54, 2018	1644	2018
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	1575*	2016
Recent developments in the ABINIT software package X Gonze, F Jollet, FA Araujo, D Adams, B Amadon, T Applencourt, ... Computer physics communications 205, 106-131, 2016	872	2016
The Abinit project: Impact, environment and recent developments X Gonze, B Amadon, G Antonius, F Arnardi, L Baguet, JM Beuken, ... Computer Physics Communications 248, 107042, 2020	637	2020
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	395	2015
The GW-Method for Quantum Chemistry Applications: Theory and Implementation MJ van Setten, F Weigend, F Evers Journal of chemical theory and computation 9 (1), 232-246, 2013	307	2013
ABINIT: Overview and focus on selected capabilities AH Romero, DC Allan, B Amadon, G Antonius, T Applencourt, L Baguet, ... The Journal of chemical physics 152 (12), 124102, 2020	288	2020
Thermodynamic stability of boron: The role of defects and zero point motion MJ van Setten, MA Uijttewaal, GA de Wijs, RA de Groot Journal of the American Chemical Society 129 (9), 2458-2465, 2007	203	2007
High-throughput densityfunctional perturbation theory phonons for inorganic materials. G Petretto, S Dwaraknath, HPC Miranda, D Winston, M Giantomassi, ... Scientific Data 5, 180065, 2018	191	2018
Electronic structure and optical properties of lightweight metal hydrides MJ van Setten, VA Popa, GA de Wijs, G Brocks Physical Review B 75 (3), 035204, 2007	178	2007
Quasi-Particle Self-Consistent GW for Molecules F Kaplan, ME Harding, C Seiler, F Weigend, F Evers, MJ van Setten Journal of chemical theory and computation 12 (6), 2528-2541, 2016	157	2016
Benchmark of GW Approaches for the GW100 Test Set F Caruso, M Dauth, MJ van Setten, P Rinke Journal of chemical theory and computation 12 (10), 5076-5087, 2016	145	2016
High-throughput design of non-oxide p-type transparent conducting materials: data mining, search strategy, and identification of boron phosphide JB Varley, A Miglio, VA Ha, MJ van Setten, GM Rignanese, G Hautier Chemistry of Materials 29 (6), 2568-2573, 2017	142	2017
Capacitor-less, long-retention (> 400s) DRAM cell paving the way towards low-power and high-density monolithic 3D DRAM A Belmonte, H Oh, N Rassoul, GL Donadio, J Mitard, H Dekkers, ... 2020 IEEE International Electron Devices Meeting (IEDM), 28.2. 1-28.2. 4, 2020	133	2020
Core-level binding energies from GW: An efficient full-frequency approach within a localized basis D Golze, J Wilhelm, MJ van Setten, P Rinke Journal of chemical theory and computation 14 (9), 4856-4869, 2018	120	2018
LiBH4− Mg(BH4)2: a physical mixture of metal borohydrides as hydrogen storage material EG Bardají, Z Zhao-Karger, N Boucharat, A Nale, MJ van Setten, ... The Journal of Physical Chemistry C 115 (13), 6095-6101, 2011	108	2011
GW100: a plane wave perspective for small molecules E Maggio, P Liu, MJ van Setten, G Kresse Journal of Chemical Theory and Computation 13 (2), 635-648, 2017	101	2017
Ab initio study of the effects of transition metal doping of Mg2NiH4 MJ van Setten, GA De Wijs, G Brocks Physical Review B 76 (7), 075125, 2007	82	2007
A density functional study of α-Mg(BH4)2 MJ van Setten, GA de Wijs, M Fichtner, G Brocks Chemistry of Materials 20 (15), 4952-4956, 2008	81*	2008
Automation methodologies and large-scale validation for GW: Towards high-throughput GW calculations MJ van Setten, M Giantomassi, X Gonze, GM Rignanese, G Hautier Physical Review B 96 (15), 155207, 2017	74	2017

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