./iterations/neb0_image09_iter61_IBZKPT output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)

Status: running

Automatically generated mesh
       4
Reciprocal lattice
    0.00000000000000    0.00000000000000    0.00000000000000             1
    0.50000000000000    0.00000000000000    0.00000000000000             1
    0.00000000000000    0.50000000000000    0.00000000000000             1
    0.50000000000000    0.50000000000000    0.00000000000000             1