Nicola Marzari

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Coauteurs

Giovanni PizziLaboratory for Materials Simulations, Paul Scherrer Institute (PSI), Villigen PSI, SwitzerlandAdresse e-mail validée de psi.ch
David VanderbiltProfessor of Physics and Astronomy, Rutgers UniversityAdresse e-mail validée de physics.rutgers.edu
Marco GibertiniUniversity of Modena and Reggio EmiliaAdresse e-mail validée de unimore.it
Matteo CococcioniUniversity of PaviaAdresse e-mail validée de unipv.it
Francesco MauriSapienza Università di RomaAdresse e-mail validée de uniroma1.it
Davide CampiUniversity of Milano-BicoccaAdresse e-mail validée de unimib.it
Andrea FerrettiSenior researcher, Nanoscience insitute, cnrAdresse e-mail validée de nano.cnr.it
Nicolas MounetPhysicist, CERNAdresse e-mail validée de cern.ch
Iurii TimrovPaul Scherrer Institut (PSI)Adresse e-mail validée de psi.ch
Young-Su LeeKorea Institute of Science and TechnologyAdresse e-mail validée de kist.re.kr
Thibault SohierCNRS, Laboratoire Charles Coulomb, MontpellierAdresse e-mail validée de umontpellier.fr
Oliviero AndreussiAssociate Professor, Department of Chemistry and Biochemistry, Boise State UniversityAdresse e-mail validée de boisestate.edu
Antimo MarrazzoJunior Assistant Professor (RTDa) at University of TriesteAdresse e-mail validée de units.it
Boris KozinskyHarvard UniversityAdresse e-mail validée de seas.harvard.edu
Andrea CepellottiHarvard University, School of Engineering and Applied SciencesAdresse e-mail validée de g.harvard.edu
Heather J. KulikChemical Engineering, Massachusetts Institute of TechnologyAdresse e-mail validée de mit.edu
Roberto CarRalph W Dornte Professor in Chemistry, Princeton University Adresse e-mail validée de princeton.edu
Arash MostofiDepartments of Materials and Physics, Imperial College LondonAdresse e-mail validée de imperial.ac.uk
Jonathan YatesDepartment of Materials, University of OxfordAdresse e-mail validée de materials.ox.ac.uk
Ivano E. CastelliAssociate Professor, Autonomous Materials Discovery, DTU EnergyAdresse e-mail validée de dtu.dk

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Nicola Marzari

École Polytechnique Fédérale de Lausanne (EPFL), and Paul Scherrer Institut (PSI)

Adresse e-mail validée de epfl.ch - Page d'accueil

computational materials science condensed matter physics density-functional theory


Titre Trier par citations Trier par année Trier par titre	Citée par Citée par	Année
QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials P Giannozzi, S Baroni, N Bonini, M Calandra, R Car, C Cavazzoni, ... Journal of physics: Condensed matter 21 (39), 395502, 2009	26614	2009
Advanced capabilities for materials modelling with Quantum ESPRESSO P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ... Journal of physics: Condensed matter 29 (46), 465901, 2017	5885	2017
Maximally localized generalized Wannier functions for composite energy bands N Marzari, D Vanderbilt Physical review B 56 (20), 12847, 1997	4631	1997
wannier90: A tool for obtaining maximally-localised Wannier functions AA Mostofi, JR Yates, YS Lee, I Souza, D Vanderbilt, N Marzari Computer physics communications 178 (9), 685-699, 2008	3471	2008
Maximally localized Wannier functions: Theory and applications N Marzari, AA Mostofi, JR Yates, I Souza, D Vanderbilt Reviews of Modern Physics 84 (4), 1419, 2012	2716	2012
Uniaxial strain in graphene by Raman spectroscopy: peak splitting, Grüneisen parameters, and sample orientation TMG Mohiuddin, A Lombardo, RR Nair, A Bonetti, G Savini, R Jalil, ... Physical Review B 79 (20), 205433, 2009	2174	2009
Maximally localized Wannier functions for entangled energy bands I Souza, N Marzari, D Vanderbilt Physical Review B 65 (3), 035109, 2001	2017	2001
An updated version of wannier90: A tool for obtaining maximally-localised Wannier functions AA Mostofi, JR Yates, G Pizzi, YS Lee, I Souza, D Vanderbilt, N Marzari Computer Physics Communications 185 (8), 2309-2310, 2014	1776	2014
Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds N Mounet, M Gibertini, P Schwaller, D Campi, A Merkys, A Marrazzo, ... Nature nanotechnology 13 (3), 246-252, 2018	1500	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	1299*	2016
First-principles determination of the structural, vibrational and thermodynamic properties of diamond, graphite, and derivatives N Mounet, N Marzari Physical Review B 71 (20), 205214, 2005	1281	2005
Thermal contraction and disordering of the Al (110) surface N Marzari, D Vanderbilt, A De Vita, MC Payne Physical review letters 82 (16), 3296, 1999	1169	1999
Wannier90 as a community code: new features and applications G Pizzi, V Vitale, R Arita, S Blügel, F Freimuth, G Géranton, M Gibertini, ... Journal of Physics: Condensed Matter 32 (16), 165902, 2020	1027	2020
Quantum ESPRESSO toward the exascale P Giannozzi, O Baseggio, P Bonfà, D Brunato, R Car, I Carnimeo, ... The Journal of chemical physics 152 (15), 2020	868	2020
Large-Area Epitaxial Monolayer MoS₂ D Dumcenco, D Ovchinnikov, K Marinov, P Lazic, M Gibertini, N Marzari, ... ACS nano 9 (4), 4611-4620, 2015	850	2015
The shear mode of multilayer graphene PH Tan, WP Han, WJ Zhao, ZH Wu, K Chang, H Wang, YF Wang, ... Nature materials 11 (4), 294-300, 2012	693	2012
Density Functional Theory in Transition-Metal Chemistry: A Self-Consistent Hubbard Approach HJ Kulik, M Cococcioni, DA Scherlis, N Marzari Physical Review Letters 97 (10), 103001, 2006	634	2006
Thermal conductivity of graphene and graphite: collective excitations and mean free paths G Fugallo, A Cepellotti, L Paulatto, M Lazzeri, N Marzari, F Mauri Nano letters 14 (11), 6109-6114, 2014	564	2014
AiiDA: automated interactive infrastructure and database for computational science G Pizzi, A Cepellotti, R Sabatini, N Marzari, B Kozinsky Computational Materials Science 111, 218-230, 2016	547	2016
Surface energies, work functions, and surface relaxations of low-index metallic surfaces from first principles NE Singh-Miller, N Marzari Physical Review B 80 (23), 235407, 2009	526	2009

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