[QE-users] error in libxc-enabled QE run: Internal List-Directed Read

Michal Krompiec michal.krompiec at gmail.com
Mon Apr 27 15:03:01 CEST 2020


Hello,
When running an epsilon.x calculation following a (successful) SCF
calculation, I am getting this error:
     Reading xml data from directory:

     ./sic.save/
forrtl: severe (24): end-of-file during read, unit -5, file Internal
List-Directed Read
Image              PC                Routine            Line        Source
epsilon.x          00000000050AB67B  Unknown               Unknown  Unknown
epsilon.x          00000000050D7C32  Unknown               Unknown  Unknown
epsilon.x          00000000050D69B8  Unknown               Unknown  Unknown
epsilon.x          000000000078B13A  Unknown               Unknown  Unknown
epsilon.x          00000000007891EB  Unknown               Unknown  Unknown
epsilon.x          0000000000423239  Unknown               Unknown  Unknown
epsilon.x          0000000000427E12  Unknown               Unknown  Unknown
epsilon.x          000000000040841C  Unknown               Unknown  Unknown
epsilon.x          0000000000407D22  Unknown               Unknown  Unknown
libc-2.22.so       00002B26D0428725  __libc_start_main     Unknown  Unknown
epsilon.x          0000000000407C29  Unknown               Unknown  Unknown

There is no indication that the wavefunctions weren't saved properly.
Exactly the same script (but with the standard QE and PBEsol
functional) works fine.
I am using QE 6.5 (yesterday's develop branch), linked with libxc
4.3.4. I would be grateful for any advice.

Thanks,
Michal


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