howto:atat
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howto:atat [2018/01/11 14:46] alopis |
howto:atat [2021/12/09 16:42] (current) |
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| + | [[http:// | ||
| - | This describes the use of ATAT which employs QE (Quantum Espresso 6.1.0). | + | |
| + | This describes the use of ATAT on Lengau and employs QE (Quantum Espresso 6.1.0). | ||
| Please find the files at | Please find the files at | ||
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| ===== One needs the following files: ===== | ===== One needs the following files: ===== | ||
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| 1. maps.pbs | 1. maps.pbs | ||
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| - | ==== One needs to edit the pbs submit script file maps.pbs appropriately: | + | ===== One needs to edit the pbs submit script file maps.pbs appropriately: |
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| #PBS -m be | #PBS -m be | ||
| #PBS -M none | #PBS -M none | ||
| - | #PBS -o / | + | #PBS -o / |
| - | #PBS -e / | + | #PBS -e / |
| #PBS | #PBS | ||
/app/dokuwiki/data/attic/howto/atat.1515674772.txt.gz · Last modified: 2021/12/09 16:42 (external edit)
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