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Published in 2020 at "Chemical Physics"
DOI: 10.1016/j.chemphys.2020.110781
Abstract: Abstract The relativistic all-electron ab initio calculations have been performed on 5f3 manifold of free U3+ ion to explore the electronic structure and spectra. The spin-orbit-free low lying electronic states have been calculated at the…
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Keywords:
electron initio;
electronic structure;
initio calculations;
electron ... See more keywords