def test_set_up_neb_folders_no_mast_coordinates(self):
mystrs=list()
pos=dict()
for posstr in ['00','01','02','03','04']:
pos[posstr] = pymatgen.io.vaspio.Poscar.from_file("structures/POSCAR_%s" % posstr)
mystrs.append(pos[posstr].structure)
kdict=dict()
kdict['images']=3
myvcneb=VaspNEBChecker(name="childdir",program_keys=kdict)
myvcneb.set_up_neb_folders(mystrs)
for subdir in ['00','01','02','03','04']:
mypos = pymatgen.io.vaspio.Poscar.from_file("childdir/POSCAR_%s" % subdir)
self.assertEqual(mypos.structure,pos[subdir].structure)
self.assertEqual(mypos.structure.lattice,pos[subdir].structure.lattice)
self.assertEqual(mypos.structure.sites,pos[subdir].structure.sites)
mypos = pymatgen.io.vaspio.Poscar.from_file("childdir/%s/POSCAR" % subdir)
self.assertEqual(mypos.structure,pos[subdir].structure)
self.assertEqual(mypos.structure.lattice,pos[subdir].structure.lattice)
self.assertEqual(mypos.structure.sites,pos[subdir].structure.sites)
