Ab initio analysis on potential superbases of several hyperlithiated species: Li 3 F 2 O and Li 3 F 2 OH n (n = 1, 2)
A systematic investigation on the potential basicity of the novel hyperlithiated species Li F O and Li F (OH) (n = 1, 2) based upon the superalkali cluster Li F was conducted using high-level ab initio techniques. Equilibrium structures for both the neutral and anionic states in the gas-phase were i...
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Veröffentlicht in: | Dalton transactions : an international journal of inorganic chemistry 2018, Vol.47 (1), p.159-168 |
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Format: | Artikel |
Sprache: | eng |
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