Table 1 The adsorption energies of different adsorption capacity within montmorillonite layer.
From: First-principle calculations of sulfur dioxide adsorption on the Ca-montmorillonite
Adsorption capacity (mmol g\(^{-1}\)) | Adsorption energy (eV) | Adsorption capacity (mmol g\(^{-1}\)) | Adsorption energy (eV) |
|---|---|---|---|
0.68 | 1.27 | 7.53 | − 5.00 |
1.37 | 1.50 | 8.22 | − 5.44 |
2.05 | 0.67 | 8.90 | − 5.75 |
2.74 | − 0.93 | 9.59 | − 6.35 |
3.42 | − 2.06 | 10.27 | − 6.85 |
4.11 | − 2.45 | 10.96 | − 7.39 |
4.79 | − 2.85 | 11.64 | − 7.90 |
5.48 | − 3.11 | 12.33 | − 8.61 |
6.16 | − 3.60 | 13.01 | − 8.99 |
6.85 | − 4.40 | 13.70 | − 9.37 |
