Differences
This shows you the differences between two versions of the page.
| Next revision | Previous revision Next revisionBoth sides next revision | ||
| admin:gaussian09 [2021/06/14 09:26] – created jz | doku:gaussian09 [2024/07/05 07:17] – [Compiling Gaussion09 with the Intel compiler] grokyta | ||
|---|---|---|---|
| Line 11: | Line 11: | ||
| The compiliation procedure discussed in this [[http:// | The compiliation procedure discussed in this [[http:// | ||
| - | < | + | **Note:** |
| - | In order to use Gaussian the user has to be <html> < | + | In order to use Gaussian the user has to be **<color #ed1c24>member of the Gaussian user group.</color>** Please, __**[[doku: |
| ===== VSC-3: submission of Gaussian jobs ===== | ===== VSC-3: submission of Gaussian jobs ===== | ||
| Line 32: | Line 32: | ||
| < | < | ||
| - | ===== .bashrc entry for Gaussian Rev A.02 ===== | ||
| - | == VSC-2: == | ||
| - | < | ||
| - | # for Gaussian Rev A.02: | ||
| - | export g09root=/ | ||
| - | export GAUSS_SCRDIR="/ | ||
| - | |||
| - | . $g09root/ | ||
| - | </ | ||
| - | ===== .bashrc entry for Gaussian Rev C.01 ===== | ||
| - | |||
| - | |||
| - | == VSC-1: == | ||
| - | < | ||
| - | # for Gaussian Rev C.01: | ||
| - | export g09root=/ | ||
| - | export GAUSS_SCRDIR=/ | ||
| - | |||
| - | . $g09root/ | ||
| - | </ | ||
| - | |||
| - | == VSC-2:== | ||
| - | For Gaussian Rev C.01 (pgi compiler): | ||
| - | < | ||
| - | export g09root=/ | ||
| - | export GAUSS_SCRDIR="/ | ||
| - | |||
| - | . $g09root/ | ||
| - | </ | ||
| - | For Gaussian Rev C.01 (intel compiler): | ||
| - | < | ||
| - | export g09root=/ | ||
| - | export GAUSS_SCRDIR="/ | ||
| - | |||
| - | . $g09root/ | ||
| - | </ | ||
| - | |||
| - | ===== .bashrc entry for Gaussian Rev D.01 ===== | ||
| - | |||
| - | == VSC-2:== | ||
| - | < | ||
| - | # for Gaussian Rev D.01: | ||
| - | export g09root=/ | ||
| - | export GAUSS_SCRDIR=/ | ||
| - | . $g09root/ | ||
| - | </ | ||