The Abinitproject: Impact, environment and recent developments
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Published:2020-03
Issue:
Volume:248
Page:107042
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ISSN:0010-4655
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Container-title:Computer Physics Communications
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language:en
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Short-container-title:Computer Physics Communications
Author:
Gonze XavierORCID, Amadon BernardORCID, Antonius Gabriel, Arnardi Frédéric, Baguet Lucas, Beuken Jean-Michel, Bieder Jordan, Bottin François, Bouchet JohannORCID, Bousquet Eric, Brouwer NilsORCID, Bruneval Fabien, Brunin GuillaumeORCID, Cavignac Théo, Charraud Jean-BaptisteORCID, Chen WeiORCID, Côté MichelORCID, Cottenier StefaanORCID, Denier Jules, Geneste Grégory, Ghosez Philippe, Giantomassi Matteo, Gillet Yannick, Gingras OlivierORCID, Hamann Donald R., Hautier Geoffroy, He XuORCID, Helbig NicoleORCID, Holzwarth Natalie, Jia Yongchao, Jollet François, Lafargue-Dit-Hauret William, Lejaeghere KurtORCID, Marques Miguel A.L.ORCID, Martin Alexandre, Martins CyrilORCID, Miranda Henrique P.C.ORCID, Naccarato Francesco, Persson Kristin, Petretto Guido, Planes Valentin, Pouillon Yann, Prokhorenko SergeiORCID, Ricci FabioORCID, Rignanese Gian-MarcoORCID, Romero Aldo H.ORCID, Schmitt Michael Marcus, Torrent Marc, van Setten Michiel J.ORCID, Van Troeye Benoit, Verstraete Matthieu J., Zérah Gilles, Zwanziger Josef W.ORCID
Funder
Fonds De La Recherche Scientifique - FNRS
Subject
General Physics and Astronomy,Hardware and Architecture
Reference211 articles.
1. The high-throughput highway to computational materials design 2. In computational materials science, such a list of codes includes VASP, Quantum Espresso, Wien2K, CASTEP, SIESTA, GPAW, CP2K, CPMD, AIMS, Exciting, and others. See https://www.nomad-coe.eu/externals/codes for links to these codes. These codes can contribute to open-access databases such as NOMAD https://metainfo.nomad-coe.eu/nomadmetainfo_public/archive.html, the Materials Cloud https://www.materialscloud.org/, the Materials Project https://www.materialsproject.org/, AFLOW http://aflowlib.org/, and OQMD http://oqmd.org/ among others. 3. ABINIT: First-principles approach to material and nanosystem properties 4. Inhomogeneous Electron Gas 5. Self-Consistent Equations Including Exchange and Correlation Effects
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