[Pw_forum] About fhi2upf.x

john Bob bobjohn.lzu at gmail.com
Sun Jul 26 07:17:46 CEST 2009


Dear Pwscf users:

       I meet a problem while using fhi2upf. "Segment fault" occures after
typing in the file name, while converting 22-Ti.LDA.fhi to upf.
22-Ti.LDA.fhi was downloaded from ABINIT website. I don't know whether it is
compilation problem. Converting 01-H.GGA.fhi successed. Convert
56-Ba.GGA.fhi (mentioned in this Forum) also successed. pwscf 405 and 41
seem have the same problem.

   Compiler : intel fortran 9.1 (10.1 tried)
   Mathlib:  mkl8.1

Eager for your answers.



Zhou  Bo
2009.7.26
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