Stochastically accelerated perturbative triples correction in coupled cluster calculations
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Author(s):
Damour, Yann; Gallo, Alejandro; Scemama, Anthony
Published in:
The Journal of Chemical Physics, 2024, ISSN 1089-7690
Publisher:
American Institute of Physics (AIP)
DOI:
10.48550/ARXIV.2405.16962
New Journal of Physics
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Author(s):
S Takatori; M Pimon; S Pollitt; M Bartokos; K Beeks; A Grüneis; T Hiraki; T Honma; N Hosseini; A Leitner; T Masuda; I Morawetz; K Nitta; K Okai; T Riebner; F Schaden; T Schumm; O Sekizawa; T Sikorsky; Y Takahashi; L Toscani De Col; R Yamamoto; T Yomogida; A Yoshimi; K Yoshimura
Published in:
New Journal of Physics, 2025, ISSN 1367-2630
Publisher:
IOP Publishing
DOI:
10.1088/1367-2630/ADCE22
Faraday Discussions
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Author(s):
Johanna P. Carbone; Andreas Irmler; Alejandro Gallo; Tobias Schäfer; William Z. Van Benschoten; James J. Shepherd; Andreas Grüneis
Published in:
Faraday Discussions, 2024, ISSN 1359-6640
Publisher:
Royal Society of Chemistry
DOI:
10.1039/D4FD00085D
Understanding discrepancies in noncovalent interaction energies from wavefunction theories for large molecules
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Author(s):
Tobias Schäfer, Andreas Irmler, Alejandro Gallo, Andreas Grüneis
Published in:
Nature Communications, Issue 16, 2025, ISSN 2041-1723
Publisher:
Springer Science and Business Media LLC
DOI:
10.1038/S41467-025-64104-8
