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Compound-tunable embedding potential method: analysis of pseudopotentials for Yb in YbF2, YbF3, YbCl2 and YbCl3 crystals.
Phys Chem Chem Phys. 2022 Aug 17;24(32):19333-19345. doi: 10.1039/d2cp01738e.
Phys Chem Chem Phys. 2022.
PMID: 35942898
The role of QED effects in transition energies of heavy-atom alkaline earth monofluoride molecules: A theoretical study of Ba+, BaF, RaF, and E120F.
Skripnikov LV, Chubukov DV, Shakhova VM.
Skripnikov LV, et al. Among authors: shakhova vm.
J Chem Phys. 2021 Oct 14;155(14):144103. doi: 10.1063/5.0068267.
J Chem Phys. 2021.
PMID: 34654288
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