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Add a faq for issue #45

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Manuel Zingl 2016-02-10 09:14:42 +01:00
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doc/faqs/faqs.rst
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@ -3,6 +3,7 @@ Frequently-Asked Questions
wien2k: FERMI ERROR when running `x lapw2 -almd -band` wien2k: FERMI ERROR when running `x lapw2 -almd -band`
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In some versions of Wien2k, there is a problem in running `x lapw2 -almd -band`. In some versions of Wien2k, there is a problem in running `x lapw2 -almd -band`.
A hack solution is as follows: A hack solution is as follows:
@ -22,10 +23,18 @@ the parameters as desired.
x optic does not write a case.pmat file x optic does not write a case.pmat file
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Make sure that you set line 6 to "ON" and put a "1" to the following line. Make sure that you set line 6 to "ON" and put a "1" to the following line.
The "1" is undocumented in Wien2k, but needed to have `case.pmat` written. The "1" is undocumented in Wien2k, but needed to have `case.pmat` written.
However, we are working on reading directly the `case.mommat2` file. However, we are working on reading directly the `case.mommat2` file.
No module named pytriqs.*** error when running a script
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Make sure that have propaly build, tested and installed TRIQS and DFTTools
using, make, make test and make install. Additionally, you should always
use pytriqs to call your scripts, e.g. pytriqs yourscript.py
Why is my calculation not working? Why is my calculation not working?
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