NGYROMAG: Difference between revisions

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{{TAGDEF|NGYROMAG|[real array]|NTYP*1.0}}
{{TAGDEF|NGYROMAG|[real array]|NTYP*1.0}}


Description: {{TAG|NGYROMAG}} specifies the nuclear gyromagnetic ratios for the atomic types on the {{FILE|POTCAR}} file.  
Description: {{TAG|NGYROMAG}} specifies the nuclear gyromagnetic ratios (in MHz, for H<sub>0</sub> = 1 T) for the atomic types on the {{FILE|POTCAR}} file.  
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By means of the {{TAG|NGYROMAG}}-tag one can specify the nuclear gyromagnetic ratio:
By means of the {{TAG|NGYROMAG}}-tag one can specify the nuclear gyromagnetic ratio:
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If one does not set {{TAG|NGYROMAG}} in the {{FILE|INCAR}} file, VASP assumes a factor of 1 for each species.
If one does not set {{TAG|NGYROMAG}} in the {{FILE|INCAR}} file, VASP assumes a factor of 1 for each species.


== Related Tags and Sections ==
== Related tags and articles ==
{{TAG|LHYPERFINE}}
{{TAG|LHYPERFINE}}


{{sc|NGYROMAG|Examples|Examples that use this tag}}
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[[The_VASP_Manual|Contents]]


[[Category:INCAR]]
[[Category:INCAR tag]][[Category:NMR]][[Category:Chemical shifts]][[Category:Electric-field gradient]]

Latest revision as of 14:23, 19 July 2022

NGYROMAG = [real array]
Default: NGYROMAG = NTYP*1.0 

Description: NGYROMAG specifies the nuclear gyromagnetic ratios (in MHz, for H0 = 1 T) for the atomic types on the POTCAR file.


By means of the NGYROMAG-tag one can specify the nuclear gyromagnetic ratio:

NGYROMAG = gamma_1  gamma_2 ... gamma_N

where one should specify one number for each of the N species on the POSCAR file. If one does not set NGYROMAG in the INCAR file, VASP assumes a factor of 1 for each species.

Related tags and articles

LHYPERFINE

Examples that use this tag