[QE-users] error while calculating InAs phonon dispersion with QE 6.5
Sheikh Ziauddin Ahmed
sza9wz at virginia.edu
Mon Oct 12 15:52:27 CEST 2020
Hello
I have been trying to calculate the InAs phonon dispersion using version
6.5 but I am getting the following error while running matdyn.x:
forrtl: severe (59): list-directed I/O syntax error, unit 1, file
/scratch/07250/sza9wz/III_V/InAs/phon2/InAs-6.fc
Image PC Routine Line Source
matdyn.x 0000000004AE4253 Unknown Unknown Unknown
matdyn.x 0000000004B21DDC Unknown Unknown Unknown
matdyn.x 0000000004B1FFC6 Unknown Unknown Unknown
matdyn.x 000000000043206F Unknown Unknown Unknown
matdyn.x 000000000041209B Unknown Unknown Unknown
matdyn.x 000000000040733E Unknown Unknown Unknown
libc-2.17.so 00002B85A8CE43D5 __libc_start_main Unknown Unknown
matdyn.x 0000000000407229 Unknown Unknown Unknown
Error reading file header
forrtl: severe (59): list-directed I/O syntax error, unit 1, file
/scratch/07250/sza9wz/III_V/InAs/phon2/InAs-6.fc
Image PC Routine Line Source
matdyn.x 0000000004AE4253 Unknown Unknown Unknown
matdyn.x 0000000004B21DDC Unknown Unknown Unknown
matdyn.x 0000000004B1FFC6 Unknown Unknown Unknown
matdyn.x 000000000043206F Unknown Unknown Unknown
matdyn.x 000000000041209B Unknown Unknown Unknown
matdyn.x 000000000040733E Unknown Unknown Unknown
libc-2.17.so 00002B3D0A84E3D5 __libc_start_main Unknown Unknown
matdyn.x 0000000000407229 Unknown Unknown Unknown
I am using the same input files for other materials and those are working
just fine. I am not sure what is causing the error for InAs.
I am attaching the input files as well.
Regards,
Sheikh
--
*Sheikh Ziauddin Ahmed *
PhD Candidate
Charles L. Brown Department of Electrical and Computer Engineering
University of Virginia
Email:sza9wz*@virginia.edu* <sza9wz at virginia.edu>
LinkedIn: https://www.linkedin.com/in/sheikh-ziauddin-ahmed
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