Ab initio analysis on potential superbases of several hyperlithiated species: Li3F2O and Li3F2OHn (n = 1, 2).
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DOI: 10.1039/c7dt03579a
Abstract: A systematic investigation on the potential basicity of the novel hyperlithiated species Li3F2O and Li3F2(OH)n (n = 1, 2) based upon the superalkali cluster Li3F2 was conducted using high-level ab initio techniques. Equilibrium structures for… read more here.
Keywords: proton; potential superbases; species li3f2o; analysis potential ... See more keywords