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| Both sides previous revision Previous revision Next revision | Previous revision Next revisionBoth sides next revision | ||
| doku:software [2017/09/08 09:51] – [Documentation] ir | doku:software [2020/04/23 08:36] – [VSC-2] ir | ||
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| Line 6: | Line 6: | ||
| the user has to be < | the user has to be < | ||
| Please, __**[[doku: | Please, __**[[doku: | ||
| - | ==== VSC-2 ==== | ||
| - | |||
| - | When logged in on VSC-2, currently installed **software** and available **libraries** can be listed by | ||
| - | < | ||
| - | [username@l21 ~]$ ls /opt/ # and | ||
| - | [username@l21 ~]$ ls /opt/sw/ | ||
| - | </ | ||
| ==== VSC-3 ==== | ==== VSC-3 ==== | ||
| Line 55: | Line 48: | ||
| * [[mpi-helium-vsc2|MPI-Helium]] | * [[mpi-helium-vsc2|MPI-Helium]] | ||
| *[[doku: | *[[doku: | ||
| + | *[[nwchem-vsc2|NWChem]] | ||
| * [[http:// | * [[http:// | ||
| *[[doku: | *[[doku: | ||
| Line 67: | Line 61: | ||
| * [[wrf-vsc2|WRFV3]] | * [[wrf-vsc2|WRFV3]] | ||
| - | === Remarks === | ||
| - | |||
| - | * [[doku: | ||
| - | |||
| - | ==== Recommendations ==== | ||
| - | |||
| - | * [[sequential-codes|Single core jobs]] | ||
| - | * [[large]] jobs with more than 1024 cores | ||
| - | * [[memory]] intensive jobs requiring more than 2 GB per core | ||
| - | * [[nwchem-vsc2|NWChem]] | ||
| - | * user defined [[prolog|prolog and epilog]] scripts | ||