Siesta

calculation hangs PDSYNTRD and PDSTEDC

Bug #1800832 reported by Prithwish Nandi

This bug report was converted into a question: question #675814: calculation hangs PDSYNTRD and PDSTEDC.

6
This bug affects 1 person
Affects Status Importance Assigned to Milestone
Siesta
Invalid
Undecided
Unassigned

Bug Description

Built Siesta-4.0.2 with Intel/2018u4 and MKL.

When run a H2O simulation, the calculation 'hangs' but giving a series of writings like the following in output:
{ 0, 5}: On entry to
PDSYNTRD parameter number 1 had an illegal value
{ 0, 0}: On entry to
PDSTEDC parameter number 10 had an illegal value

Revision history for this message
Prithwish Nandi (prithwish) wrote :

I am not sure if it is a bug, or related to some wrong inputs.

Changed in siesta:
status: New → Invalid
Revision history for this message
Nick Papior (nickpapior) wrote :

This is a known problem with Intel MKL, they have been informed of the bug.

Please add this to your input, and it should be resolved:

Diag.Memory 2.

Revision history for this message
Nick Papior (nickpapior) wrote :

Note that the above fix is only for the 4.0 versions.

4.1 is _not_ affected by this.

To post a comment you must log in.
This report contains Public information  
Everyone can see this information.
Subscribing...

Other bug subscribers

Related questions

Remote bug watches

Bug watches keep track of this bug in other bug trackers.