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doku:gamess [2014/09/11 13:01] – sh | doku:gamess [2014/09/11 13:56] – sh |
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cp /opt/sw/gamess/gamess_may_2013/rungms ./ | cp /opt/sw/gamess/gamess_may_2013/rungms ./ |
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* Double-check the settings in ''gamess_sge.scrpt'' and select the above input file as the current JOB variable (dropping the '.inp' extension) | * Double-check the settings in ''h2o.inp'' and ''gamess_sge.scrpt'' and select ''h2o.inp'' as the current JOB variable in ''gamess_sge.scrpt'' (dropping the '.inp' extension) |
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vi ./gamess_sge.scrpt | vi ./gamess_sge.scrpt |
* Check out additional problems from /opt/sw/gamess/gamess_may_2013/tests | * Check out additional problems from /opt/sw/gamess/gamess_may_2013/tests |
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[[http://www.msg.chem.iastate.edu/gamess/index.html|GAMESS(US) web-home ]] | ===== Further Information ===== |
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| | **Overview** | /opt/sw/gamess/gamess_may_2013/INTRO.DOC | |
| | **Input Description** | /opt/sw/gamess/gamess_may_2013/INPUT.DOC | |
| | **Input Examples** | /opt/sw/gamess/gamess_may_2013/TESTS.DOC | |
| | **Further Information** | /opt/sw/gamess/gamess_may_2013/REFS.DOC | |
| | **Programmer's Reference** | /opt/sw/gamess/gamess_may_2013/PROG.DOC | |
| | **Hardware Specifics** | /opt/sw/gamess/gamess_may_2013/IRON.DOC | |
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| [[http://www.msg.chem.iastate.edu/gamess/index.html|GAMESS(US) www-home ]] |