Table 3. Henry Coefficient KH (mol g–1 bar–1) of Methane in UiO-66 at T = 298 K.
| Dreiding-UFF/TraPPE | 1.78 |
| UFF/TraPPE | 2.36 |
| MM3-MBIS | 1.21 |
| SAPTFF | 1.87 |
| MEDFF | 1.08 |
| experiment | 0.60 |
| PBE-D3MBJ-ATM | 0.91 |
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