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New approaches to study excited states in density functional theory: general discussion.
Faraday Discuss. 2020 Dec 4;224(0):483-508. doi: 10.1039/D0FD90026E.
Faraday Discuss. 2020.
PMID: 33245076
No abstract available.
Challenges for large scale simulation: general discussion.
Brandenburg JG, Burke K, Civalleri B, Cole DJ, Csányi G, David G, Gidopoulos NI, Gowland D, Helgaker T, Herbst MF, Hourahine B, Irons TJP, Jacob CR, Loos PF, Mehta N, Mulay MR, Neugebauer J, Pernal K, Pribram-Jones A, Romaniello P, Ryder MR, Savin A, Sirbu D, Skylaris CK, Truhlar DG, Wetherell J, Yang W.
Brandenburg JG, et al. Among authors: mulay mr.
Faraday Discuss. 2020 Dec 4;224(0):309-332. doi: 10.1039/D0FD90024A.
Faraday Discuss. 2020.
PMID: 33227116
No abstract available.
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New density-functional approximations and beyond: general discussion.
Brandenburg JG, Burke K, Cancio A, Erhard J, Fromager E, Ghosal A, Gidopoulos N, Gori-Giorgi P, Helgaker T, Hourahine B, Jacob CR, Kooi D, Maitra N, Mulay MR, Pernal K, Pribram-Jones A, Reining L, Romaniello P, Ryder MR, Savin A, Skylaris CK, Teale AM, Tozer D, Truhlar DG, Yang W.
Brandenburg JG, et al. Among authors: mulay mr.
Faraday Discuss. 2020 Dec 4;224(0):166-200. doi: 10.1039/D0FD90023K.
Faraday Discuss. 2020.
PMID: 33232402
No abstract available.
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