VASP installation on Fujitsu A64FX platforms

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

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ivr900
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VASP installation on Fujitsu A64FX platforms

#1 Post by ivr900 » Tue Oct 05, 2021 11:53 pm

NCI Australia has some collaboration with Fujitsu Ltd. Japan in part of software porting on Fujitsu platforms. As part of this work, started by Roger Amos (roger_amos1) and continued by me, VASP porting has been done for Fujitsu A64FX platforms. It assumes use of Fujitsu HPC compiler suite (Fujitsu compilers, math. libraries, MPI).

I believe it would be in interest of both the VASP Team and the world-wide community of VASP users, if the VASP distribution hardware support list would be extended.

Could somebody from the VASP Developers Team contact me regarding of this? I would like to pass you files, like makefile.include template and some code patches, with all necessary instructions to incorporate the Fujitsu A64FX support into the current VASP source code distribution.

With best regards,
Ivan Rostov
NCI Australia, Canberra
ivan.rostov@anu.edu.au

andreas.singraber
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Re: VASP installation on Fujitsu A64FX platforms

#2 Post by andreas.singraber » Wed Oct 06, 2021 7:20 am

Dear Ivan Rostov,

of course there is great interest in supporting this platform also on our side, thank you for contacting us! I have already forwarded your previous email to Martijn Marsman who is handling the porting to A64FX, he will contact you soon!

All the best,

Andreas Singraber

ivr900
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Re: VASP installation on Fujitsu A64FX platforms

#3 Post by ivr900 » Thu Oct 07, 2021 11:16 pm

Dear Andreas,

thank you for the news. I look forward to be contacted by Martijn Marsman.

With regards,

Ivan

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