Re: [Wien] running wien2k on cluster

Also, it looks like job.out tells you that the problem is: slurm_script: line 12: hostlist : command not found My guess is that whomever setup slurm didn't get it from the slurm download website [1] and install it. If pip is installed, it can likely be installed using [2]: sudo pip install

Re: [Wien] running wien2k on cluster

As constructed your .machines file will only run lapw0 using mpi, and is missing lines for how to run lapw1. User error. On Wed, Apr 26, 2017 at 4:15 PM, ahmed amine wrote: > Hello, > > i have problem running on a cluster, I can't run paralel calculation > > dayfile >

[Wien] running wien2k on cluster

Hello, i have problem running on a cluster, I can't run paralel calculation dayfile start (mer. avril 26 21:48:01 CET 2017) with lapw0 (40/99 to go) cycle 1 (mer. avril 26 21:48:01 CET 2017) (40/99 to go) > lapw0 -p(21:48:01) starting parallel lapw0 at mer. avril 26

Re: [Wien] dos-band-plot together

There should be multiple ways to do that. For example: (a) Copy and paste the separate plots side by side in Microsoft PowerPoint. (b) Plot the data as a Horizontal 2 Panel Graph in Origin [ http://www.originlab.com/doc/Origin-Help/Horizontal-2-Panel-Graph ]. That likely can be done using