Category:Symmetry: Difference between revisions
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VASP determines the '''symmetry''' of the structure by analyzing the ionic position and velocities given in the {{FILE|POSCAR}} file and the {{TAG|MAGMOM}} tag in the {{FILE|INCAR}} file. Additionally, the {{TAG|ISYM}} tag determines the symmetry operations applied to quantities such as the electronic charge density, Kohn-Sham orbitals, etc, during the calculation. | VASP determines the '''symmetry''' of the structure by analyzing the ionic position and velocities given in the {{FILE|POSCAR}} file and the {{TAG|MAGMOM}} tag in the {{FILE|INCAR}} file. Additionally, the {{TAG|ISYM}} tag determines the symmetry operations applied to quantities such as the electronic charge density, Kohn-Sham orbitals, etc, during the calculation. We introduce [https://youtu.be/rvGwCdQEO7Q symmetry in VASP] in a lecture on our YouTube channel. | ||
Latest revision as of 10:07, 22 September 2025
VASP determines the symmetry of the structure by analyzing the ionic position and velocities given in the POSCAR file and the MAGMOM tag in the INCAR file. Additionally, the ISYM tag determines the symmetry operations applied to quantities such as the electronic charge density, Kohn-Sham orbitals, etc, during the calculation. We introduce symmetry in VASP in a lecture on our YouTube channel.
Pages in category "Symmetry"
The following 15 pages are in this category, out of 15 total.