Research Article
Rare Gas Adsorption to Silver-Exchanged Zeolites
Table 4
Adsorption energies of rare gas atoms on silver aluminosilicate (kJ/mol).
| | He | Ne | Ar | Kr | Xe |
| LDA | −10.461 | −23.807 | −38.416 | −40.546 | −105.778 | GGA | −7.639 | 6.721 | −6.378 | 0.186 | −5.242 | DFT-D | −17.282 | −19.858 | −52.759 | −59.165 | −76.568 |
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