Results (
Thai) 1:
[Copy]Copied!
The Mg2SiO4 surface (100) was simulated using a 4x1x1 (i.e., 19.235x10.364x6.063 Å3) supercell,which corresponds to a four-layer slab with symmetry and with the inclusion of a dipole correction. Thissupercell was selected to investigate the effect of coverage in the water adsorption mode.
Being translated, please wait..
