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howto:orca [2018/07/16 11:05] alopis |
howto:orca [2026/02/26 15:22] (current) alopis |
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| - | **ORCA** is available on Lengau, but we require users to be licensed/ | + | **ORCA** is available on Lengau, but we require users to be **licensed/ |
| ====ORCA job submission==== | ====ORCA job submission==== | ||
| - | Execute **qorca_3.0.3** on login node and follow the prompts. | + | Execute **//qorca_6.1.0//** on login node and follow the prompts |
| This script handles PBS setup and submission. | This script handles PBS setup and submission. | ||
| Sets up the mpi environment variables allowing you to run over multiple processors and nodes. | Sets up the mpi environment variables allowing you to run over multiple processors and nodes. | ||
| Examples of script execution are provided below. | Examples of script execution are provided below. | ||
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| + | **Note**, please first include this **module load** - even better if your add this line to your .bashrc, then the Easy Scripts should be visible and available (**// | ||
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| + | module load chpc/ | ||
| EXAMPLE1 | EXAMPLE1 | ||