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LOBSTER: Local orbital projections, atomic charges, and chemical‐bonding analysis from projector‐augmented‐wave‐based density‐functional theoryNelson, Ryky ; Ertural, Christina ; George, Janine ; Deringer, Volker L. ; Hautier, Geoffroy ; Dronskowski, RichardJournal of computational chemistry, 2020-08, Vol.41 (21), p.1931-1940 [Periódico revisado por pares]Hoboken, USA: John Wiley & Sons, IncTexto completo disponível |
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Material Type: Artigo
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Plane Wave Backgrounds in the Worldline FormalismEdwards, James P. ; Schubert, ChristianJournal of physics. Conference series, 2022-04, Vol.2249 (1), p.12019 [Periódico revisado por pares]Bristol: IOP PublishingTexto completo disponível |
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Critical Angle Formulation of Nonuniform Plane Waves for Determining Correct Refraction Angles at Planar InterfaceKim, Yongwan ; Yang, Hyunjun ; Oh, JungsuekIEEE transactions on antennas and propagation, 2023-03, Vol.71 (3), p.1-1 [Periódico revisado por pares]New York: IEEETexto completo disponível |
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Material Type: Artigo
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Theory for Twisted Bilayer Photonic Crystal SlabsLou, Beicheng ; Zhao, Nathan ; Minkov, Momchil ; Guo, Cheng ; Orenstein, Meir ; Fan, ShanhuiPhysical review letters, 2021-04, Vol.126 (13), p.136101-136101, Article 136101 [Periódico revisado por pares]United States: American Physical SocietyTexto completo disponível |
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Material Type: Artigo
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Maximally supersymmetric solutions of R2 supergravityKuzenko, Sergei MPhysical review. D, 2016-09, Vol.94 (6) [Periódico revisado por pares]College Park: American Physical SocietyTexto completo disponível |
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Material Type: Artigo
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Wien2wannier: From linearized augmented plane waves to maximally localized Wannier functionsKuneš, Jan ; Arita, Ryotaro ; Wissgott, Philipp ; Toschi, Alessandro ; Ikeda, Hiroaki ; Held, KarstenComputer physics communications, 2010-11, Vol.181 (11), p.1888-1895 [Periódico revisado por pares]Elsevier B.VTexto completo disponível |
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Material Type: Artigo
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Erratum: “Achieving plane wave accuracy in linear-scaling density functional theory applied to periodic systems: A case study on crystalline silicon” [J. Chem. Phys. 127, 164712 (2007)]Skylaris, Chris-Kriton ; Haynes, Peter D.The Journal of chemical physics, 2020-03, Vol.152 (11), p.119901-119901 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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CP2K: An electronic structure and molecular dynamics software package - Quickstep: Efficient and accurate electronic structure calculationsKühne, Thomas D. ; Iannuzzi, Marcella ; Del Ben, Mauro ; Rybkin, Vladimir V. ; Seewald, Patrick ; Stein, Frederick ; Laino, Teodoro ; Khaliullin, Rustam Z. ; Schütt, Ole ; Schiffmann, Florian ; Golze, Dorothea ; Wilhelm, Jan ; Chulkov, Sergey ; Bani-Hashemian, Mohammad Hossein ; Weber, Valéry ; Borštnik, Urban ; Taillefumier, Mathieu ; Jakobovits, Alice Shoshana ; Lazzaro, Alfio ; Pabst, Hans ; Müller, Tiziano ; Schade, Robert ; Guidon, Manuel ; Andermatt, Samuel ; Holmberg, Nico ; Schenter, Gregory K. ; Hehn, Anna ; Bussy, Augustin ; Belleflamme, Fabian ; Tabacchi, Gloria ; Glöß, Andreas ; Lass, Michael ; Bethune, Iain ; Mundy, Christopher J. ; Plessl, Christian ; Watkins, Matt ; VandeVondele, Joost ; Krack, Matthias ; Hutter, JürgThe Journal of chemical physics, 2020-05, Vol.152 (19), p.194103-194103 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Fast Pairwise Conversion of Supernova Neutrinos: A Dispersion Relation ApproachIzaguirre, Ignacio ; Raffelt, Georg ; Tamborra, IrenePhysical review letters, 2017-01, Vol.118 (2), p.021101-021101, Article 021101 [Periódico revisado por pares]United States: American Physical SocietyTexto completo disponível |
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Material Type: Artigo
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WIEN2k: An APW+lo program for calculating the properties of solidsBlaha, Peter ; Schwarz, Karlheinz ; Tran, Fabien ; Laskowski, Robert ; Madsen, Georg K. H. ; Marks, Laurence D.The Journal of chemical physics, 2020-02, Vol.152 (7), p.074101-074101 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |