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Changed 'orb' parameter to 'ish' for consistency

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Hermann Schnait 2019-06-05 09:24:53 +02:00
parent 51275c772d
commit 743ff09cac
1 changed files with 4 additions and 4 deletions
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8
python/sumk_dft.py
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@ -1692,7 +1692,7 @@ class SumkDFT(object):
return sigma_minus_dc return sigma_minus_dc
def symm_deg_gf(self, gf_to_symm, orb): def symm_deg_gf(self, gf_to_symm, ish=0):
r""" r"""
Averages a GF over degenerate shells. Averages a GF over degenerate shells.
@ -1704,8 +1704,8 @@ class SumkDFT(object):
---------- ----------
gf_to_symm : gf_struct_solver like gf_to_symm : gf_struct_solver like
Input and output GF (i.e., it gets overwritten) Input and output GF (i.e., it gets overwritten)
orb : int ish : int
Index of an inequivalent shell. Index of an inequivalent shell. (default value 0)
""" """
@ -1713,7 +1713,7 @@ class SumkDFT(object):
# an h5 file, self.deg_shells might be None # an h5 file, self.deg_shells might be None
if self.deg_shells is None: return if self.deg_shells is None: return
for degsh in self.deg_shells[orb]: for degsh in self.deg_shells[ish]:
# ss will hold the averaged orbitals in the basis where the # ss will hold the averaged orbitals in the basis where the
# blocks are all equal # blocks are all equal
# i.e. maybe_conjugate(v^dagger gf v) # i.e. maybe_conjugate(v^dagger gf v)