Challenges for large scale simulation: general discussion

Jan Gerit Brandenburg, Kieron Burke, Bartolomeo Civalleri, Daniel J Cole, Gábor Csányi, Grégoire David, Nikitas I Gidopoulos, Duncan Gowland, Trygve Helgaker, Michael F Herbst, Ben Hourahine, Tom JP Irons, Christoph R Jacob, Pierre-François Loos, Nisha Mehta, Manasi R Mulay, Johannes Neugebauer, Katarzyna Pernal, Aurora Pribram-Jones, Pina RomanielloMatthew R Ryder, Andreas Savin, Dumitru Sirbu, Chris-Kriton Skylaris, Donald G Truhlar, Jack Wetherell, Weitao Yang

Research output: Contribution to journalComment/debatepeer-review

Original languageEnglish
Pages (from-to)309-332
Number of pages24
JournalFaraday Discussions
Volume224
Early online date23 Nov 2020
DOIs
Publication statusPublished - 1 Dec 2020

Keywords

  • Broken-Symmetry dterminant
  • large scale simulation
  • verdazyl radical dimers

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