Vasp.sh

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The script vasp.sh prepares and submits a .sub file to the queue you want to run it.

Script Syntax: vasp.sh job queue proc

  job is the name of the job you want to run.

  queue is the type of processor where you want to run the job.
  (Available Options: c0:mono; q0:quad; c4m8:4cores with 8GB; c8m24:8cores with 24GB; c12m48ib:12cores with 48GB and Infini Band).

  proc is the number of processors you want to use for the calculation.                 

Example: vasp.sh example c4m8 16 ==> the script prepares and submits a file called example.sub to the c4m8 queue using 16 procs (tekla2).

INSTALLATION STEPS

1) First of all, download the script:

      File:Vasp.tgz

and uncompress it.

NOTE: If you want to use this script from whatever directory you are working on, save it into a directory that exists in your $PATH (check it by typing: echo $PATH).