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@ARTICLE{Teale:910402,
author = {Teale, Andrew M. and Helgaker, Trygve and Savin, Andreas
and Adamo, Carlo and Aradi, Bálint and Arbuznikov, Alexei
V. and Ayers, Paul W. and Baerends, Evert Jan and Barone,
Vincenzo and Calaminici, Patrizia and Cancès, Eric and
Carter, Emily A. and Chattaraj, Pratim Kumar and Chermette,
Henry and Ciofini, Ilaria and Crawford, T. Daniel and De
Proft, Frank and Dobson, John F. and Draxl, Claudia and
Frauenheim, Thomas and Fromager, Emmanuel and Fuentealba,
Patricio and Gagliardi, Laura and Galli, Giulia and Gao,
Jiali and Geerlings, Paul and Gidopoulos, Nikitas and Gill,
Peter M. W. and Gori-Giorgi, Paola and Görling, Andreas and
Gould, Tim and Grimme, Stefan and Gritsenko, Oleg and
Jensen, Hans Jørgen Aagaard and Johnson, Erin R. and Jones,
Robert O. and Kaupp, Martin and Köster, Andreas M. and
Kronik, Leeor and Krylov, Anna I. and Kvaal, Simen and
Laestadius, Andre and Levy, Mel and Lewin, Mathieu and Liu,
Shubin and Loos, Pierre-François and Maitra, Neepa T. and
Neese, Frank and Perdew, John P. and Pernal, Katarzyna and
Pernot, Pascal and Piecuch, Piotr and Rebolini, Elisa and
Reining, Lucia and Romaniello, Pina and Ruzsinszky, Adrienn
and Salahub, Dennis R. and Scheffler, Matthias and
Schwerdtfeger, Peter and Staroverov, Viktor N. and Sun,
Jianwei and Tellgren, Erik and Tozer, David J. and Trickey,
Samuel B. and Ullrich, Carsten A. and Vela, Alberto and
Vignale, Giovanni and Wesolowski, Tomasz A. and Xu, Xin and
Yang, Weitao},
title = {{DFT} exchange: sharing perspectives on the workhorse of
quantum chemistry and materials science},
journal = {Physical chemistry, chemical physics},
volume = {24},
number = {47},
issn = {1463-9076},
address = {Cambridge},
publisher = {RSC Publ.},
reportid = {FZJ-2022-03791},
pages = {28700-28781},
year = {2022},
abstract = {In this paper, the history, present status, and future of
density-functional theory (DFT) is informally reviewed and
discussed by 70 workers in the field, including molecular
scientists, materials scientists, method developers and
practitioners. The format of the paper is that of a
roundtable discussion, in which the participants express and
exchange views on DFT in the form of 300 individual
contributions, formulated as responses to a preset list of
26 questions. Supported by a bibliography of 776 entries,
the paper represents a broad snapshot of DFT, anno 2022.},
cin = {IAS-1 / PGI-1 / JARA-FIT / JARA-HPC},
ddc = {540},
cid = {I:(DE-Juel1)IAS-1-20090406 / I:(DE-Juel1)PGI-1-20110106 /
$I:(DE-82)080009_20140620$ / $I:(DE-82)080012_20140620$},
pnm = {5211 - Topological Matter (POF4-521)},
pid = {G:(DE-HGF)POF4-5211},
typ = {PUB:(DE-HGF)16},
pubmed = {36269074},
UT = {WOS:000870798400001},
doi = {10.1039/D2CP02827A},
url = {https://juser.fz-juelich.de/record/910402},
}