Hi,
I am trying to use the “thermo_style custom xlat ylat zlat” command to find the lattice spacings at each timestep. I am getting an error;
ERROR: Invalid keyword in thermo_style custom command
The script works without the “xlat ylat zlat” entries. The other quantities monitored are;
thermo_style custom step temp ke etotal vol press enthalpy
I am using a custom lattice with a1 a2 a3 & basis.
Could you let me know the reason for this error or if there are any changes to the syntax to find the lattice spacings.
Thanks,
Mihir.