Hi,
A user at the an Diego Supercomputer Center reports the this error with his IBRION=8 calculation with vasp 5.4.4:
internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
The executables continue to run but no more output is produced.
The input and stdout and stderr files are in the attached tar file.
Thanks,
Jerry
internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
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internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
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Re: internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
Hi,
I did not find the stdout in the attached tar file. Could you send it as well?
In the meantime, I will try to reproduce this issue using vasp.5.4.4 and vasp.6.x
I did not find the stdout in the attached tar file. Could you send it as well?
In the meantime, I will try to reproduce this issue using vasp.5.4.4 and vasp.6.x
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Re: internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
Actually, I am able to reproduce this issue with vasp.5.4.4 but not using the latest vasp.6 version.
In this case, I would recommend the user to consider upgrading their license to vasp.6 if they want to use IBRION=8 (DFPT driver).
Alternatively, he might consider using IBRION=6 (finite differences driver).
In this case, I would recommend the user to consider upgrading their license to vasp.6 if they want to use IBRION=8 (DFPT driver).
Alternatively, he might consider using IBRION=6 (finite differences driver).
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Re: internal ERROR: LINEAR_RESPONSE_DIIS matrix is zero, try to call with LRESET
I thought I tried vasp 6.4.2 and got the same thing but I'll try it again ( I also changed I ibrion to 6 )
Thanks
Jerry
Thanks
Jerry