[molpro-user] how to make the temporary files written in my home directory

Benj FitzPatrick benjfitz at uchicago.edu
Wed Sep 9 20:34:45 BST 2009


Hi there,
You need to change TMPDIR and TMPDIR4 (you can also set other scratch
directories using SCRDIR).

I run molpro from a script where I have,

export TMPDIR="/initio/scratch/benjfitz/"
export TMPDIR4="/initio/scratch/benjfitz/"

In this case you'd want /initio/scratch/benjfitz/ to be your home directory.
Cheers,
Benj

---- Original message ----
>Date: Wed, 9 Sep 2009 13:10:47 -0500
>From: Hui Li <huili.nju at gmail.com>  
>Subject: [molpro-user] how to make the temporary files written in my home
directory  
>To: molpro-user at molpro.net
>
>   Hi molpro users,
>
>   I have met a problem in CCSD calculation. During the calculation, some
>   temporary files were written in my root directory, but the root disk
>   has only 40 Gb space in my system. So the root disk is filled soon,
>   and the job died. My home directory has 400Gb space. I think there
>   should be some command or variables can make the temporary files
>   written in the home directory. Does somebody know it?
>
>   Thank you very much!
>
>   Hui Li
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