exercises:2017_uzh_cmest:calculation_pbc
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exercises:2017_uzh_cmest:calculation_pbc [2017/10/11 09:08] – tmueller | exercises:2017_uzh_cmest:calculation_pbc [2017/10/11 09:09] – tmueller | ||
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====== Calculations with Periodic Boundary Conditions ====== | ====== Calculations with Periodic Boundary Conditions ====== | ||
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* Try to document the script in such a way that you will still understand it when looking at it again in a year or two (so, not every detail, but make sure to cover the obscure stuff and the big blocks) | * Try to document the script in such a way that you will still understand it when looking at it again in a year or two (so, not every detail, but make sure to cover the obscure stuff and the big blocks) | ||
* Change the script to calculate energies for '' | * Change the script to calculate energies for '' | ||
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exercises/2017_uzh_cmest/calculation_pbc.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1