[QE-users] QE and BoltzTraP

NEELESH GUPTA rse2017003 at iiita.ac.in
Thu Mar 22 09:12:14 CET 2018


Dear PWSCF users/experts,
                                         I have run boltztrap calculations
(after nscf calculations with dense k mesh in quantum espresso). Now I need
to plot *electrical, thermal conductivities, Seebeck coefficient, figure of
merit etc (vs. Temp.)* from output files. Now I have *.trace* file with 10
columns in total.  Could you please tell me the procedure of plotting them?
Which software is good here for plotting?






Thank you very much.



Warm regards
Neelesh Gupta
Research Scholar,ECE
IIIT Allahabad, India.
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