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exercises:2017_uzh_cmest:pdos

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exercises:2017_uzh_cmest:pdos [2017/10/25 07:47] – [Getting the band structure of WO$_3$ Lattice] tmuellerexercises:2017_uzh_cmest:pdos [2017/10/25 09:39] – [Getting the band structure of WO$_3$ Lattice] tmueller
Line 186: Line 186:
       &KPOINTS       &KPOINTS
          SCHEME MONKHORST-PACK 3 3 1          SCHEME MONKHORST-PACK 3 3 1
-         SYMMETRY OFF 
          WAVEFUNCTIONS REAL          WAVEFUNCTIONS REAL
-         FULL_GRID .TRUE.+         SYMMETRY .FALSE. 
 +         FULL_GRID .FALSE.
          PARALLEL_GROUP_SIZE  0          PARALLEL_GROUP_SIZE  0
       &END KPOINTS       &END KPOINTS
exercises/2017_uzh_cmest/pdos.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1