Preparing a Super Cell: Difference between revisions
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Latest revision as of 09:47, 6 April 2022
Task
This tutorial shows how to get POSCAR files containing a super cell from an initially smaller cell.
Super cells from p4vasp
- Open p4vasp by typing p4v on the terminal.
- Load the primitive cell by clicking on File→Load system:
- Multiply cell in each direction (enter 3 for each direction) by clicking on Edit→Multiply Cell:
- Save new system by clicking on File→Save system as:
