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dft_tools
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SumkDFT: check the supplied gf for every shell 

in analyse_block_structure_from_gf and
analyse_deg_shells
This commit is contained in:
Gernot J. Kraberger 2018-03-01 16:09:24 +01:00
parent 318c5a36e7
commit a63169e45f
1 changed files with 4 additions and 4 deletions
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8
python/sumk_dft.py
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@ -884,7 +884,7 @@ class SumkDFT(object):
"""
# make a GfImTime from the supplied G
if isinstance(G[0]._first(), GfImFreq):
if all(isinstance(g_sh._first(), GfImFreq) for g_sh in G):
gf = [BlockGf(name_block_generator = [(name, GfImTime(beta=block.mesh.beta,
indices=block.indices,n_points=len(block.mesh)+1)) for name, block in g_sh])
for g_sh in G]
@ -892,7 +892,7 @@ class SumkDFT(object):
for name, g in gf[ish]:
g.set_from_inverse_fourier(G[ish][name])
else:
assert isinstance(G[0]._first(), GfImTime), "G must be a BlockGf of either GfImFreq or GfImTime"
assert all(isinstance(g_sh._first(), GfImTime) for g_sh in G), "G must be a BlockGf of either GfImFreq or GfImTime"
gf = G
# initialize the variables
@ -1003,7 +1003,7 @@ class SumkDFT(object):
return null_space.conjugate().transpose()
# make a GfImTime from the supplied G
if isinstance(G[0]._first(), GfImFreq):
if all(isinstance(g_sh._first(), GfImFreq) for g_sh in G):
gf = [BlockGf(name_block_generator = [(name, GfImTime(beta=block.mesh.beta,
indices=block.indices,n_points=len(block.mesh)+1)) for name, block in g_sh])
for g_sh in G]
@ -1011,7 +1011,7 @@ class SumkDFT(object):
for name, g in gf[ish]:
g.set_from_inverse_fourier(G[ish][name])
else:
assert isinstance(G[0]._first(), GfImTime), "G must be a BlockGf of either GfImFreq or GfImTime"
assert all(isinstance(g_sh._first(), GfImTime) for g_sh in G), "G must be a BlockGf of either GfImFreq or GfImTime"
gf = G
if include_shells is None: