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--- howto:running_qe_computation [2019/12/23 20:54] – [How to do calculations like Quantum ESPRESSO] oschuett
+++ howto:running_qe_computation [2021/12/08 10:18] (current) – mtaillefumier
@@ Line 420: / Line 420: @@
 ^ QE keyword ^ CP2K (SIRIUS) keyword  ^ section ^ desciption ^
 | nspins = 1, 2  | NUM_MAG_DIMS = 0, 1 | PW_DFT/PARAMETERS | computation in LDA and SLDA |
-| nocolin = true | NUM_MAG_DIMS = 2    | PW_DFT/PARAMETERS | non colinear magnetism |
+| nocolin = true | NUM_MAG_DIMS = 3    | PW_DFT/PARAMETERS | non colinear magnetism |
 | electron_maxstep | NUM_DFT_ITER | PW_DFT/PARAMETERS | number of scf iterations |
 | mixing_beta | beta| PW_DFT/MIXER| mixing parameter for the broyden mixer|