[Beowulf] [owner-chemistry at ccl.net: CCL:G: parallel G03 in Linux cluster]
jac67 at georgetown.edu
Fri Mar 17 14:08:32 EST 2006
Eugen Leitl wrote:
>I am planning to buy sixteen AMD64 Athlon dual core machines (with
>Linux) for running G03 in parallel. They will be connected by ethernet.
>I never have any experience in running gaussian with Linux cluster. So
>my questions are the following:
>1. Can G03 be run parallel in the above configuration?
>2. Do you need to have Linda for running parallel in the above
You need Linda to run G03 in parallel.
>3. Do you recommend any other processor?
We run G03 on both Xeon and Opteron Beowulf Clusters and are very
pleased with the Opterons.
>4. Which brand of Linux is good for running G03 parallel?
This depends on whether you have the binary or source code version. If
you use the binaries, you should follow Gaussian's recommendations. We
run G03 (64-bit) on SuSE 9.0 and RedHat AS 4 without any problems.
>5. Pals sharer your experience with running G03 parallel in Linux
>cluster (like tricks, problems, failure etc).
Good luck! G03 can be finicky.
>Thanks in advance
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