Are your files "Case*" or "case*" ?
What is the name of your directory ?
The capital letter makes a big difference.
Otherwise, I believe you used -f FILEHEAD in a wrong way (and this
option may even not work).
If our directory is called "case" and all your files also start with
"case", you should not use -f filehead. This option is only used
when the files are named differently than the directory.
I suggest you repeat parabolfit without this option.
Otherwise it could be that you should edit the following line in parabolfit:
echo $type | x_lapw eosfit6
change to:
echo $type | x_lapw -f $file eosfit6
Am 20.11.2022 um 10:22 schrieb ma.azadparvar:
Dear Wien2k users,
I have optimized a monoclinic structure with option 7 "vary A, B, C ,
and gamma (4D-case) monoclinic lattice". After optimization without any
error (using 7 81 1%), I want to obtain lattice parameters. So by
running the “parabolfit_lapw”:
parabolfit_lapw -t 2/3/4 -f FILEHEAD -scf '*case*.scf' -g
After running, I have faced with following error:
/bin/ls:no match.
The following scf files were used for analysis:
Case_1_defult.scf
.
.
.
Case_81_defult.scf
FILEHEAD.ene and FILEHEAD.latparam generated
ERROR IN OPENING UNIT: 10
FILE NAME:
Case.ene
STATUS:old
FORM:formatted
OPEN FAILED
0.008u 0.004s 0:00.01 0.0% 0+0k 0+0io 0pf+0w
Please let me know how to solve this problem?
Thank you in advance.
*Maliheh Azadparvar*
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Phone: +43-1-58801-165300
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