maxent script #197
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quantumable
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This is a duplicate from TRIQS/maxent#23 . Please report your issues only once. I will close the discussion here. |
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I did some DMFT calculations using dft_tools but I'm a bit stuck on the maxent analysis.
indeed i made the calculation for two correlated atoms which i want to plot each of the orbitals d(dxy,dxy,dz2,dxz,dx2-y2) for atom1 and 2. i used the model of the maxent script present here MAXENT.
i attach here the example of my maxent file. and the error message please do you have an idea for these two atoms? and when the calculation is spin polarized?
ERROR:
Traceback (most recent call last):
File "max.py", line 40, in
gf = gf + G_latt['up'][iO,iO]
File /TRIQS/install/lib/python3.8/site-packages/triqs/gf/gf.py", line 359, in getitem
dat = self._data[ self._rank*(slice(0,None),) + key_tpl ]
IndexError: index 5 is out of bounds for axis 1 with size 5
script.zip
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