geometry file
Posted: Sun Jan 11, 2009 2:43 pm
Dear vasp users,
I check a file which contains the geometry of the system after calculation (distance between atoms, angles...). I think this informations are not contained in the CONTCAR file which is similar to the POSCAR file.
Thank you for your answers,
I check a file which contains the geometry of the system after calculation (distance between atoms, angles...). I think this informations are not contained in the CONTCAR file which is similar to the POSCAR file.
Thank you for your answers,