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huangj3 created page: ab initio molecular dynamics benchmarking authored by Doak, Peter W.'s avatar Doak, Peter W.
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...@@ -39,6 +39,13 @@ Use them by adding: ...@@ -39,6 +39,13 @@ Use them by adding:
#PBS -l qos=condo #PBS -l qos=condo
``` ```
## Sample PBS Scripts ##
There are examples for most of the installed codes in the repo.
```shell
cd your-code-dir
git clone git@code.ornl.gov:CNMS/CNMS_Computing_Resources.git
```
## CODES ## ## CODES ##
Instructions for codes: Instructions for codes:
Please read these, you can waste a great deal of resources if you do not understand how to run even familiar codes optimally in this hardware environment. Please read these, you can waste a great deal of resources if you do not understand how to run even familiar codes optimally in this hardware environment.
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