[Wannier] Restarting problem

Jonathan Yates jonathan.yates at materials.ox.ac.uk
Sun Dec 31 00:29:19 CET 2017


On 30 Dec 2017, at 09:47, paresh rout <paresh.rout88 at gmail.com> wrote:

> Dear Wannier90 users and developers:
> 
> My wannier function optimization has stopped at certain step as the job get killed in-between.  I am having problem with restarting the calculation (both with default and wannierise option). Is there a way to restart from the previous step?.  Any help would be highly appreciated.

Dear Paresh,

 You cannot restart during the disentanglement stage. However, you can restart during the wannierisation stage, from the chk file.
 restart=default is the required keyword.

Jonathan


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