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Browsing School of Science and Technology (2015-2019) by Subject "correlated-Gaussian calculations"
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Bubin, Sergiy; Adamowicz, Ludwik
(2011)
Benchmark variational calculations of the four lowest 2P and 2S states of the boron atom (including the ground state) have been performed. The wave functions of the states have been expanded in terms of all-particle ...