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exercises:2019_conexs_newcastle:ex1

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exercises:2019_conexs_newcastle:ex1 [2019/09/11 12:30] – [Part 2: Running an single-point calculation] abussyexercises:2019_conexs_newcastle:ex1 [2019/09/11 12:34] – [Part 2: Running an single-point calculation] abussy
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 sbatch cp2k.sh sbatch cp2k.sh
 </code> </code>
-iif you are logged in to the cluster and have modified the //cp2k.sh// accordingly. When the program is finished, you will have two new files in your working directory:+if you are logged in to the cluster and have modified the //cp2k.sh// accordingly. When the program is finished, you will have two new files in your working directory:
 <code> <code>
 water.out    water.out   
exercises/2019_conexs_newcastle/ex1.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1