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Reproducibility in density functional theory calculations of solids

Authors :
Lejaeghere, K.
Bihlmayer, G.
Bjorkman, T.
Blaha, P.
Blugel, S.
Blum, V.
Caliste, D.
Castelli, I.E.
Clark, S.J.
Dal Corso, A.
de Gironcoli, S.
Deutsch, T.
Dewhurst, J.K.
Di Marco, I.
Draxl, C.
Dulak, M.
Eriksson, O.
Flores-Livas, J.A.
Garrity, K.F.
Genovese, L.
Giannozzi, P.
Giantomassi, M.
Goedecker, S.
Gonze, X.
Granas, O.
Gross, E.K.U.
Gulans, A.
Gygi, F.
Hamann, D.R.
Hasnip, P.J.
Holzwarth, N.A.W.
Iusan, D.
Jochym, D.B.
Jollet, F.
Jones, Daniel
Kresse, G.
Koepernik, K.
Kucukbenli, E.
Kvashnin, Y.O.
Locht, I.L.M.
Lubeck, S.
Marsman, M.
Marzari, N.
Nitzsche, U.
Nordstrom, L.
Ozaki, T.
Paulatto, L.
Pickard, C.J.
Poelmans, W.
Probert, M.I.J.
Refson, K.
Richter, M.
Rignanese, G.M.
Saha, S.
Scheffler, M.
Schlipf, M.
Schwarz, K.
Sharma, Sangeeta
Tavazza, F.
Thunstrom, P.
Tkatchenko, A.
Torrent, M.
Vanderbilt, D.
van Setten, M.J.
Van Speybroeck, V.
Wills, J.M.
Yates, J.R.
Zhang, G.X.
Cottenier, S.
Lejaeghere, K.
Bihlmayer, G.
Bjorkman, T.
Blaha, P.
Blugel, S.
Blum, V.
Caliste, D.
Castelli, I.E.
Clark, S.J.
Dal Corso, A.
de Gironcoli, S.
Deutsch, T.
Dewhurst, J.K.
Di Marco, I.
Draxl, C.
Dulak, M.
Eriksson, O.
Flores-Livas, J.A.
Garrity, K.F.
Genovese, L.
Giannozzi, P.
Giantomassi, M.
Goedecker, S.
Gonze, X.
Granas, O.
Gross, E.K.U.
Gulans, A.
Gygi, F.
Hamann, D.R.
Hasnip, P.J.
Holzwarth, N.A.W.
Iusan, D.
Jochym, D.B.
Jollet, F.
Jones, Daniel
Kresse, G.
Koepernik, K.
Kucukbenli, E.
Kvashnin, Y.O.
Locht, I.L.M.
Lubeck, S.
Marsman, M.
Marzari, N.
Nitzsche, U.
Nordstrom, L.
Ozaki, T.
Paulatto, L.
Pickard, C.J.
Poelmans, W.
Probert, M.I.J.
Refson, K.
Richter, M.
Rignanese, G.M.
Saha, S.
Scheffler, M.
Schlipf, M.
Schwarz, K.
Sharma, Sangeeta
Tavazza, F.
Thunstrom, P.
Tkatchenko, A.
Torrent, M.
Vanderbilt, D.
van Setten, M.J.
Van Speybroeck, V.
Wills, J.M.
Yates, J.R.
Zhang, G.X.
Cottenier, S.
Source :
Science; 1415; U81; 0036-8075; 6280; 351; ~Science~1415~U81~~~0036-8075~6280~351~~
Publication Year :
2016

Abstract

Contains fulltext : 158675.pdf (Publisher’s version ) (Closed access)

Details

Database :
OAIster
Journal :
Science; 1415; U81; 0036-8075; 6280; 351; ~Science~1415~U81~~~0036-8075~6280~351~~
Publication Type :
Electronic Resource
Accession number :
edsoai.on1284124585
Document Type :
Electronic Resource

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