[Wien] Is there any automate infrastructure supporting WIEN2k?

[Peter Blaha]

No, not really as far as I know. You have to use the wien2k scripts, 
tutorials and/or the graphical user interface w2web, which teaches you 
how to perform certain tasks.

There is a fairly old interface called   "runwien" by a spanish group, 
but I've never used it myself nor do I know if it would be compatible 
with the latest version.

Anyway, it was on github: 
https://github.com/aoterodelaroza/runwien/blob/master/doc/user-guide.txt



Am 02.07.2019 um 14:01 schrieb 林敏:
> Dear WIEN2k expert,
> 
> Is there any automate infrastructure supporting WIEN2k? Just like AiiDA supporting VASP, QE, CP2K, etc.
> 
> Best wishes.
> 
> Min Lin, Chemistry Department, Xiamen University, China.
> Email: linmin at stu.xmu.edu.cn
> 
> 
> 
> 
> 
> 
> 
> 
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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