Editing Adjust.sh

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The script ''adjust.sh'' prepares a .sub file, ready to be run on the queue you want.

'''Launching''': ''adjust.sh queue proc comp'' 
           ''queue'' is the type of processor where I want to run the calculation; acceptable options: c0 q0 c4m8 c8m24

           ''proc'' is the number of processors
           ''comp'' is where we are running the calculation; available options: tekla1|tek1|t1 for tekla and tekla2|tek2|t2 for tekla2

'''Output file''': ''file'' (without the ''.com'' extension; ready to be read with p4v, for example)

'''Used files/subprograms''': ''x.mInv''




== INSTALLATION STEPS ==



1) First of all, download the program:

       [[Image:gv_vasp.tgz]]

and uncompress it.


2) As soon as you have done it, get this:

       [[Image:mInv.tgz]]

uncompress it and compile it: 
'' g77 mInv.f -o x.mInv'' 
and put it in the directory you want (named, for simplicity, directory A).


3) CHANGE THE PATH THAT APPEARS IN LINE 12 of gv_vasp.sh

   /home/lbellarosa/src/complex/Cell  ===>  path of directory A

the path where you put your ''x.mInv'' program (i.e., /home/nlopez/Trabajo/directory A/x.mInv).


4) Now you can run the script typing:

       gv_vasp.sh file