Author: "Deutsch, Thierry" - OpacWWW

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Title:: Reproducibility in density functional theory calculations of solids
Authors:: Lejaeghere, Kurt
Bihlmayer, Gustav
Björkman, Torbjörn
Blaha, Peter
Blügel, Stefan
Blum, Volker
Caliste, Damien
Castelli, Ivano E.
Clark, Stewart J.
Dal Corso, Andrea
de Gironcoli, Stefano
Deutsch, Thierry
Dewhurst, John Kay
Di Marco, Igor
Draxl, Claudia
Dułak, Marcin
Eriksson, Olle
Flores-Livas, José A.
Garrity, Kevin F.
Genovese, Luigi
Giannozzi, Paolo
Giantomassi, Matteo
Goedecker, Stefan
Gonze, Xavier
Grånäs, Oscar
Gross, E. K. U.
Gulans, Andris
Gygi, François
Hamann, D. R.
Hasnip, Phil J.
Holzwarth, N. A. W.
Iuşan, Diana
Jochym, Dominik B.
Jollet, François
Jones, Daniel
Kresse, Georg
Koepernik, Klaus
Küçükbenli, Emine
Kvashnin, Yaroslav O.
Locht, Inka L. M.
Lubeck, Sven
Marsman, Martijn
Marzari, Nicola
Nitzsche, Ulrike
Nordström, Lars
Ozaki, Taisuke
Paulatto, Lorenzo
Pickard, Chris J.
Poelmans, Ward
Probert, Matt I. J.
Refson, Keith
Richter, Manuel
Rignanese, Gian-Marco
Saha, Santanu
Scheffler, Matthias
Schlipf, Martin
Schwarz, Karlheinz
Sharma, Sangeeta
Tavazza, Francesca
Thunström, Patrik
Tkatchenko, Alexandre
Torrent, Marc
Vanderbilt, David
van Setten, Michiel J.
Van Speybroeck, Veronique
Wills, John M.
Yates, Jonathan R.
Zhang, Guo-Xu
Cottenier, Stefaan; Show more
Source:: Science, 2016 Mar . 351(6280), 1415-1415.
Access URL:: http://www.jstor.org/stable/24742655 Link opens in a new window

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Title:: Optimizing 3D Convolutions for Wavelet Transforms on CPUs with SSE Units and GPUs
Authors:: Videau, Brice
Marangozova-Martin, Vania
Genovese, Luigi
Deutsch, Thierry; Show more
Source:: Euro-Par 2013 Parallel Processing : 19th International Conference, Aachen, Germany, August 26-30, 2013. Proceedings. 8097:826-837

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Title:: Wavelet-based linear-response time-dependent density-functional theory
Authors:: Natarajan, Bhaarathi
Genovese, Luigi
Casida, Mark E.
Deutsch, Thierry
Burchak, Olga N.
Philouze, Christian
Balakirev, Maxim Y.; Show more
Source:: In Chemical Physics 19 June 2012 402:29-40

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Title:: Non-Born–Oppenheimer Dynamics and Conical Intersections
Authors:: Casida, Mark E.
Natarajan, BhaarathiAff6, Aff7
Deutsch, Thierry; Show more
Source:: Fundamentals of Time-Dependent Density Functional Theory. 837:279-299

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Title:: Magnetic anisotropy in icosahedral cobalt clusters
Authors:: Morel, Robert
Brenac, Ariel
Portemont, Céline
Deutsch, Thierry
Notin, Lucien; Show more
Source:: In Journal of Magnetism and Magnetic Materials 2007 308(2):296-304

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Title:: Electron–phonon coupling and charge-transfer excitations in organic systems from many-body perturbation theory: The Fiesta code, an efficient Gaussian-basis implementation of the GW and Bethe–Salpeter formalisms
Authors:: Faber, Carina
Duchemin, Ivan
Deutsch, Thierry
Attaccalite, Claudio
Olevano, Valerio
Blase, Xavier; Show more
Source:: Journal of Materials Science: Full Set - Includes `Journal of Materials Science Letters'. November 2012 47(21):7472-7481

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Title:: Au service du progrès des connaissances.
Authors:: Deutsch, Thierry
Brun, Allan Sacha
Ferri, Federico; Show more
Source:: Clefs CEA. Nov2021, Issue 73, p22-23. 2p.

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Title:: An efficient 3-dim FFT for plane wave electronic structure calculations on massively parallel machines composed of multiprocessor nodes
Authors:: Goedecker, Stefan
Boulet, Mireille
Deutsch, Thierry; Show more
Source:: In Computer Physics Communications 2003 154(2):105-110

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Title:: Corrigendum to “Wavelet-based linear-response time-dependent density-functional theory: Excited-states modeling of fluorescent compounds with UV–vis spectra calculations” [Chem. Phys. 402 (2012) 29]
Authors:: Natarajan, Bhaarathi
Genovese, Luigi
Deutsch, Thierry
Casida, Mark E.; Show more
Source:: In Chemical Physics 3 June 2014 436-437:63-64

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Title:: Structure determination of the ( [formula omitted]) reconstructed α-Al 2O 3(0 0 0 1)
Authors:: Vilfan, Igor
Deutsch, Thierry
Lançon, Frédéric
Renaud, Gilles; Show more
Source:: In Surface Science 2002 505:L215-L221

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Title:: Erratum to: “Structure determination of the (3√ of 3×33×3√ of 3) reconstructed α-Al2O3(0 0 0 1)” [Surf. Sci. 505 (2002) L215]
Authors:: Vilfan, Igor
Deutsch, Thierry
Lançon, Frédéric
Renaud, Gilles; Show more
Source:: Surface Science. Apr2003, Vol. 529 Issue 1/2, p281. 1p.

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Title:: Structure determination of the (3√ of 3×33×3√ of 3) reconstructed α-Al2O3(0 0 0 1)
Authors:: Vilfan, Igor
Deutsch, Thierry
Lançon, Frédéric
Renaud, Gilles; Show more
Source:: Surface Science. May2002, Vol. 505 Issue 1-3, pL215. 0p.

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