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Fix spaghetti in sumk_lda_tools

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This commit is contained in:
Leonid Pourovskii 2014-01-21 17:35:12 +01:00
parent ea3151b77a
commit 8b18315408
1 changed files with 4 additions and 4 deletions
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8
python/sumk_lda_tools.py
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@ -423,7 +423,7 @@ class SumkLDATools(SumkLDA):
if (ishell is None):
# non-projected A(k,w)
for iom in range(n_om):
if (M[iom]>om_minplot) and (M[iom]<om_maxplot):
if (M[iom].real>om_minplot) and (M[iom].real<om_maxplot):
if fermi_surface:
for sig,gf in S: Akw[sig][ik,0] += gf.data[iom,:,:].imag.trace()/(-3.1415926535) * (M[1]-M[0])
else:
@ -445,7 +445,7 @@ class SumkLDATools(SumkLDA):
# for sig,gf in Gproj: Gproj[sig] <<= self.rotloc(0,gf,direction='toLocal')
for iom in range(n_om):
if (M[iom]>om_minplot) and (M[iom]<om_maxplot):
if (M[iom].real>om_minplot) and (M[iom].real<om_maxplot):
for ish in range(self.shells[ishell][3]):
for ibn in bln:
Akw[ibn][ish,ik,iom] = Gproj[ibn].data[iom,ish,ish].imag/(-3.1415926535)
@ -476,7 +476,7 @@ class SumkLDATools(SumkLDA):
f.write('%s %s\n'%(ik,Akw[ibn][ik,0]))
else:
for iom in range(n_om):
if (M[iom]>om_minplot) and (M[iom]<om_maxplot):
if (M[iom].real>om_minplot) and (M[iom].real<om_maxplot):
if (invert_Akw):
Akw[ibn][ik,iom] = 1.0/(minAkw-maxAkw)*(Akw[ibn][ik,iom] - maxAkw)
if (shift>0.0001):
@ -500,7 +500,7 @@ class SumkLDATools(SumkLDA):
for ik in range(self.n_k):
for iom in range(n_om):
if (M[iom]>om_minplot) and (M[iom]<om_maxplot):
if (M[iom].real>om_minplot) and (M[iom].real<om_maxplot):
if (invert_Akw):
Akw[ibn][ish,ik,iom] = 1.0/(minAkw-maxAkw)*(Akw[ibn][ish,ik,iom] - maxAkw)
if (shift>0.0001):