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Viser treff 1-7 av 7

2020
1 Folkestad, Sarai Dery; Kjønstad, Eirik Fadum; Myhre, Rolf Heilemann; Andersen, Josefine; Balbi, Alice; Coriani, Sonia; Giovannini, Tommaso; Goletto, Linda; Haugland, Tor Strømsem; Hutcheson, Anders; Høyvik, Ida-Marie; Moitra, Torsha; Paul, Alexander Christian; Scavino, Marco; Skeidsvoll, Andreas Sæther; Tveten, Åsmund; Koch, Henrik.
eT 1.0: An open source electronic structure program with emphasis on coupled cluster and multilevel methods. Journal of Chemical Physics 2020 ;Volum 152.(18) s. 184103-184103-13
NTNU Untitled
 
2019
2 Folkestad, Sarai Dery; Kjønstad, Eirik Fadum; Koch, Henrik.
An efficient algorithm for Cholesky decomposition of electron repulsion integrals. Journal of Chemical Physics 2019 ;Volum 150.(19) s. 194112-
NTNU Untitled
 
3 Folkestad, Sarai Dery; Koch, Henrik.
Multilevel CC2 and CCSD Methods with Correlated Natural Transition Orbital. Journal of Chemical Theory and Computation 2019 (16) s. 179-189
NTNU Untitled
 
4 Folkestad, Sarai Dery; Koch, Henrik.
Performance of MLCC2 and MLCCSD. NKS Quantum Chemistry Meeting; 2019-10-08 - 2019-10-09
NTNU Untitled
 
2018
5 Folkestad, Sarai Dery; Kjønstad, Eirik Fadum; Koch, Henrik.
Efficient Cholesky decomposition algorithms for multilevel methods. Methods and Algorithms in Quantum Chemistry; 2018-12-13 - 2018-12-15
NTNU Untitled
 
2017
6 Folkestad, Sarai Dery; Høyvik, Ida-Marie; Koch, Henrik.
Multilevel coupled cluster theory for valence and core excited states. 11th Triennial Congress of the World Association of Theoretical and Computational Chemistry; 2017-08-27 - 2017-09-01
NTNU Untitled
 
2016
7 Folkestad, Sarai Dery.
Coupled Cluster for High-Spin Open-Shell Systems. : NTNU-IKJ 2016 67 s.
NTNU Untitled