Can neutral clusters: a two-step G0W0 and DFT benchmark
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DOI: 10.3762/bjnano.15.82
Abstract: Electronic and structural properties of calcium clusters with a varying size range of 2–20 atoms are studied using a two-step scheme within the GW and density functional theory (DFT) with generalized gradient approximation (GGA). The… read more here.
Keywords: neutral clusters; cluster; ionization potentials; two step ... See more keywords