events:2018_summer_school:scf_setup
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| events:2018_summer_school:scf_setup [2018/06/17 09:32] – [Other parameters] mwatkins | events:2018_summer_school:scf_setup [2020/08/21 10:15] (current) – external edit 127.0.0.1 | ||
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| - | System size affects the efficiency too. You can find larger water boxes in the ${main directory of my cp2k installation}/ | + | System size affects the efficiency too. You can find larger water boxes in the '' |
| Change the CELL parameters and the coordinates of the atoms and see how the methods scale. | Change the CELL parameters and the coordinates of the atoms and see how the methods scale. | ||
| + | You could also explore how the methods scale with number of processors used. | ||
| </ | </ | ||
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| + | < | ||
| + | And of course, probably the most important ' | ||
events/2018_summer_school/scf_setup.1529227949.txt.gz · Last modified: (external edit)
