Use of CALYPSO in SLURM-based HPC

[Paras Patel]

Dear CALYPSO community, 

I am interested in using CALYPSO on a SLURM-based HPC with Intel servers. I am seeking assistance in understanding the workflow and the necessary steps for installation. 

Could you kindly provide me with information on the essential prerequisites and important aspects I should be aware of before using CALYPSO on this specific HPC setup? Furthermore, in case there is no available installation of CALYPSO on the HPC cluster, I would like to know how to run CALYPSO locally on my desktop while utilizing the remote HPC resources for VASP calculations. 

Thank you for your support and guidance. 

Best regards, 

Paras

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[Pengyue gao]

CALYPSO doesn't need to be installed. More details can be found in the manual and references [Phys. Rev. B 82, 094116 (2010); Comput. Phys. Commun. 183, 2063 (2012)].