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1 Ergebnisse
1
The Effect of the Combination of Basis and Functional on th..:
, In:
2023 Applied Mathematics, Computational Science and Mechanics: Current Problems (AMCSM)
,
Borshch, Nadezda
;
Pereslavtseva, Natalia
;
Kurganskii, Sergei
. - p. 1-7 , 2023
Link:
https://doi.org/10.1109/AMCSM59829.2023.10526178
RT T1
2023 Applied Mathematics, Computational Science and Mechanics: Current Problems (AMCSM)
: T1
The Effect of the Combination of Basis and Functional on the Results of DFT-calculation of Atomic Structure of Silicon-Hafnium Anionic Clusters
UL https://suche.suub.uni-bremen.de/peid=ieee-10526178&Exemplar=1&LAN=DE A1 Borshch, Nadezda A1 Pereslavtseva, Natalia A1 Kurganskii, Sergei A1 Maksimova, Ekaterina YR 2023 K1 Scientific computing K1 Density functional theory K1 Optimization K1 density functional theory K1 clusters K1 spectra K1 binding energy K1 silicon SP 1 OP 7 LK http://dx.doi.org/https://doi.org/10.1109/AMCSM59829.2023.10526178 DO https://doi.org/10.1109/AMCSM59829.2023.10526178 SF ELIB - SuUB Bremen
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