Reproducibility in density functional theory calculations of solids (bibtex)
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Reference:
"Reproducibility in density functional theory calculations of solids" Kurt Lejaeghere, Gustav Bihlmayer, Torbjörn Björkman, Peter Blaha, Stefan Blügel, Volker Blum, Damien Caliste, Ivano E. Castelli, Stewart J. Clark, Andrea Dal Corso, Stefano de Gironcoli, Thierry Deutsch, John Kay Dewhurst, Igor Di Marco, Claudia Draxl, Marcin Dulak, Olle Eriksson, José A. Flores-Livas, Kevin F. Garrity, Luigi Genovese, Paolo Giannozzi, Matteo Giantomassi, Stefan Goedecker, Xavier Gonze, Oscar Grånäs, E. K. U. Gross, Andris Gulans, François Gygi, D. R. Hamann, Phil J. Hasnip, N. A. W. Holzwarth, Diana Iucsan, Dominik B. Jochym, François Jollet, Daniel Jones, Georg Kresse, Klaus Koepernik, Emine Küçükbenli, Yaroslav O. Kvashnin, Inka L. M. Locht, Sven Lubeck, Martijn Marsman, Nicola Marzari, Ulrike Nitzsche, Lars Nordström, Taisuke Ozaki, Lorenzo Paulatto, Chris J. Pickard, Ward Poelmans, Matt I. J. Probert, Keith Refson, Manuel Richter, Gian-Marco Rignanese, Santanu Saha, Matthias Scheffler, Martin Schlipf, Karlheinz Schwarz, Sangeeta Sharma, Francesca Tavazza, Patrik Thunström, Alexandre Tkatchenko, Marc Torrent, David Vanderbilt, Michiel J. van Setten, Veronique Van Speybroeck, John M. Wills, Jonathan R. Yates, Guo-Xu Zhang, Stefaan Cottenier Science 351, aad3000 (2016).doi:10.1126/science.aad3000 [bibtex] [pdf]
Bibtex Entry:
@article {Lejaeghe2016,
	author = {{Lejaeghere, Kurt and Bihlmayer, Gustav and Bj{\"o}rkman, Torbj{\"o}rn and Blaha, Peter and Bl{\"u}gel, Stefan and Blum, Volker and Caliste, Damien and Castelli, Ivano E. and Clark, Stewart J. and Dal Corso, Andrea and de Gironcoli, Stefano and Deutsch, Thierry and Dewhurst, John Kay and Di Marco, Igor and Draxl, Claudia and Dulak, Marcin and Eriksson, Olle and Flores-Livas, Jos{\'e} A. and Garrity, Kevin F. and Genovese, Luigi and Giannozzi, Paolo and Giantomassi, Matteo and Goedecker, Stefan and Gonze, Xavier and Gr{\r a}n{\"a}s, Oscar and Gross, E. K. U. and Gulans, Andris and Gygi, Fran{\c c}ois and Hamann, D. R. and Hasnip, Phil J. and Holzwarth, N. A. W. and Iucsan, Diana and Jochym, Dominik B. and Jollet, Fran{\c c}ois and Jones, Daniel and Kresse, Georg and Koepernik, Klaus and K{\"u}{\c c}{\"u}kbenli, Emine and Kvashnin, Yaroslav O. and Locht, Inka L. M. and Lubeck, Sven and Marsman, Martijn and Marzari, Nicola and Nitzsche, Ulrike and Nordstr{\"o}m, Lars and Ozaki, Taisuke and Paulatto, Lorenzo and Pickard, Chris J. and Poelmans, Ward and Probert, Matt I. J. and Refson, Keith and Richter, Manuel and Rignanese, Gian-Marco and Saha, Santanu and Scheffler, Matthias and Schlipf, Martin and Schwarz, Karlheinz and Sharma, Sangeeta and Tavazza, Francesca and Thunstr{\"o}m, Patrik and Tkatchenko, Alexandre and Torrent, Marc and Vanderbilt, David and van Setten, Michiel J. and Van Speybroeck, Veronique and Wills, John M. and Yates, Jonathan R. and Zhang, Guo-Xu and Cottenier, Stefaan}},
	title = {Reproducibility in density functional theory calculations of solids},
	volume = {351},
	number = {6280},
	year = {2016},
        pages= {aad3000},
        Month                    = mar,
	doi = {10.1126/science.aad3000},
	publisher = {American Association for the Advancement of Science},
	journal = {Science},
        URL = {http://science.sciencemag.org/content/351/6280/aad3000.full.pdf}
}
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