casm.vasp.io.Outcar

class casm.vasp.io.Outcar(filename)[source]

Parse OUTCAR files.

Currently, just contains:

self.complete = True/False self.slowest_loop = float self.kpoints = list of int, or none self.orbital_occupations = dict of OrbitalOccupation objects, from last step (only available when LDAUPRINT = 1 or 2). Keys are indices of only those sites for which occupation was printed.

__init__(filename)[source]

Methods

__init__(filename)

read()

Parse OUTCAR file.