Example Jobs and Performance Figures for VASP 5.2 (and B3LYP)

Questions regarding the compilation of VASP on various platforms: hardware, compilers and libraries, etc.

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andypea

Example Jobs and Performance Figures for VASP 5.2 (and B3LYP)

#1 Post by andypea » Tue Jul 24, 2012 2:35 am

Hi,

I have recently installed VASP 5.2 on my cluster. However, a number of operations appear to run suspiciously slowly. I want to determine whether this is due to a problem with the compilation/linking or with my input files.

Does anyone have some working examples, together with example outputs, from their cluster? In particular I would like to test the new B3LYP functionality in VASP 5.2.

Thanks,

Andy
Last edited by andypea on Tue Jul 24, 2012 2:35 am, edited 1 time in total.

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