Stephan Lany

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Alex ZungerUniversity of Colorado ,Boulder,Colorado.Renewable and Sustainable Energy InstituteVerified email at colorado.edu
Andriy ZakutayevNational Renewable Energy LaboratoryVerified email at nrel.gov
Vladan StevanovicColorado School of MinesVerified email at mines.edu
Haowei PengN/AVerified email at temple.edu
Adele TamboliNational Renewable Energy LabVerified email at nrel.gov
Hannes RaebigerYokohama National UniversityVerified email at ynu.ac.jp
Paweł ZawadzkiStaff Data Scientist @ IntuitVerified email at intuit.com
Eric TobererProfessor of Physics; Director of Materials Science Program, Colorado School of MinesVerified email at mines.edu
Laura SchelhasNational Renewable Energy LaboratoryVerified email at nrel.gov
Elisabetta ArcaLecturer in Experimental Physics, Newcastle UniversityVerified email at tcd.ie
Sebastian SiolGroup Leader, Empa - Swiss Federal Laboratories for Materials Science and TechnologyVerified email at empa.ch
Janet TateProfessor of Physics, Oregon State UniversityVerified email at physics.oregonstate.edu
Anuj GoyalAssistant Professor IIT HyderabadVerified email at msme.iith.ac.in
Lauryn BaranowskiNational Renewable Energy LaboratoryVerified email at nrel.gov
Tula R. PaudelSouth Dakota School of Mines and TechnologyVerified email at sdsmt.edu
Jorge Mario Osorio GuillénInstituto de Física, Universidad de AntioquiaVerified email at udea.edu.co
Xiuwen ZhangAssistant Research Professor, Renewable and Sustainable Energy Institute, University of ColoradoVerified email at colorado.edu
Joseph J BerryNational renewable energy laboratory, Renewable Sustainable Energy Institute & Department of PhysicsVerified email at nrel.gov
Philip A ParillaNational Renewable Energy LaboratoryVerified email at nrel.gov
Clas PerssonKTH Royal Institute of Technology, SwedenVerified email at kth.se

Stephan Lany

National Renewable Energy Laboratory

Verified email at NREL.gov

defect and alloy theory materials design energy materials transition metal oxides


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Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 78 (23), 235104, 2008	1433	2008
Dopability, intrinsic conductivity, and nonstoichiometry of transparent conducting oxides S Lany, A Zunger Physical Review Letters 98 (4), 045501, 2007	1391	2007
Anion vacancies as a source of persistent photoconductivity in II-VI and chalcopyrite semiconductors S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 72 (3), 035215, 2005	723	2005
Correcting density functional theory for accurate predictions of compound enthalpies of formation: Fitted elemental-phase reference energies V Stevanović, S Lany, X Zhang, A Zunger Physical Review B—Condensed Matter and Materials Physics 85 (11), 115104, 2012	637	2012
Origins of the -type nature and cation deficiency in and related materials H Raebiger, S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 76 (4), 045209, 2007	636	2007
-type doping of and C Persson, YJ Zhao, S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 72 (3), 035211, 2005	600	2005
Band-structure, optical properties, and defect physics of the photovoltaic semiconductor SnS J Vidal, S Lany, M d’Avezac, A Zunger, A Zakutayev, J Francis, J Tate Applied Physics Letters 100 (3), 2012	498	2012
Accurate prediction of defect properties in density functional supercell calculations S Lany, A Zunger Modelling and simulation in materials science and engineering 17 (8), 084002, 2009	468	2009
Polaronic hole localization and multiple hole binding of acceptors in oxide wide-gap semiconductors S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 80 (8), 085202, 2009	450	2009
Light-and bias-induced metastabilities in Cu (In, Ga) Se2 based solar cells caused by the (VSe-VCu) vacancy complex S Lany, A Zunger Journal of Applied Physics 100 (11), 2006	428	2006
A map of the inorganic ternary metal nitrides W Sun, CJ Bartel, E Arca, SR Bauers, B Matthews, B Orvañanos, ... Nature materials 18 (7), 732-739, 2019	412	2019
Defect tolerant semiconductors for solar energy conversion A Zakutayev, CM Caskey, AN Fioretti, DS Ginley, J Vidal, V Stevanovic, ... The journal of physical chemistry letters 5 (7), 1117-1125, 2014	408	2014
Electronic structures of , and CuO: A joint experimental and theoretical study Y Wang, S Lany, J Ghanbaja, Y Fagot-Revurat, YP Chen, F Soldera, ... Physical Review B 94 (24), 245418, 2016	382	2016
Magnetism without Magnetic Ions: Percolation, Exchange, and Formation Energies<? format?> of Magnetism-Promoting Intrinsic Defects in CaO J Osorio-Guillén, S Lany, SV Barabash, A Zunger Physical review letters 96 (10), 107203, 2006	382	2006
The 2019 materials by design roadmap K Alberi, MB Nardelli, A Zakutayev, L Mitas, S Curtarolo, A Jain, M Fornari, ... Journal of Physics D: Applied Physics 52 (1), 013001, 2018	352	2018
The electronic structure of chalcopyrites—bands, point defects and grain boundaries S Siebentritt, M Igalson, C Persson, S Lany Progress in Photovoltaics: Research and Applications 18 (6), 390-410, 2010	333	2010
Charge self-regulation upon changing the oxidation state of transition metals in insulators H Raebiger, S Lany, A Zunger Nature 453 (7196), 763-766, 2008	307	2008
Origins of the doping asymmetry in oxides: Hole doping in NiO versus electron doping in ZnO S Lany, J Osorio-Guillén, A Zunger Physical Review B—Condensed Matter and Materials Physics 75 (24), 241203, 2007	301	2007
Intrinsic defects in ZnO calculated by screened exchange and hybrid density functionals SJ Clark, J Robertson, S Lany, A Zunger Physical Review B—Condensed Matter and Materials Physics 81 (11), 115311, 2010	295	2010
Semiconducting transition metal oxides S Lany Journal of Physics: Condensed Matter 27 (28), 283203, 2015	294	2015

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