3
This is my configuration in extended xyz format 8 Lattice="5.30478009012 0.0312272946092 0.308531804143 0.296228192315 5.4283625362 -0.153770906252 0.107142908862 0.25388495613 5.28850183842" Properties=species:S:1:pos:R:3:force:R:3:Z:I:1 pbc="T T T" config_type=A15 energy=-100.15189673 virial="-...