poscarUtils#

pyprocar.pyposcar.poscar_modify(poscar[, ...])

High-level class to change properties of a Poscar-object.

pyprocar.pyposcar.poscar_supercell(poscar[, ...])

class to generate a supercell by providing a supercell matrix.

pyprocar.pyposcar.poscarDiff(poscar1, poscar2)

It compares two different Poscar objects.