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Coupled cluster theory on modern heterogeneous supercomputers.
Corzo HH, Hillers-Bendtsen AE, Barnes A, Zamani AY, Pawłowski F, Olsen J, Jørgensen P, Mikkelsen KV, Bykov D. Corzo HH, et al. Among authors: jorgensen p. Front Chem. 2023 Jun 14;11:1154526. doi: 10.3389/fchem.2023.1154526. eCollection 2023. Front Chem. 2023. PMID: 37388945 Free PMC article.
Corrigendum: Coupled cluster theory on modern heterogeneous supercomputers.
Corzo HH, Hillers-Bendtsen AE, Barnes A, Zamani AY, Pawłowski F, Olsen J, Jørgensen P, Mikkelsen KV, Bykov D. Corzo HH, et al. Among authors: jorgensen p. Front Chem. 2023 Aug 15;11:1256510. doi: 10.3389/fchem.2023.1256510. eCollection 2023. Front Chem. 2023. PMID: 37654900 Free PMC article.
Cluster perturbation theory. X. A parallel implementation of Lagrangian perturbation series for the coupled cluster singles and doubles ground-state energy through fifth order.
Hillers-Bendtsen AE, Kjeldal FØ, Høyer NM, Johansen MB, Juncker von Buchwald T, Iuel Lunøe Dünweber PG, Olsen LH, Jensen F, Olsen J, Jørgensen P, Mikkelsen KV. Hillers-Bendtsen AE, et al. Among authors: jorgensen p. J Chem Phys. 2024 Nov 14;161(18):184111. doi: 10.1063/5.0234183. J Chem Phys. 2024. PMID: 39530365
1,147 results