POMASS: Difference between revisions
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{{TAG|ZVAL}} and {{TAG|POMASS}} determine the valency and the atomic mass of each atomic species | {{TAG|ZVAL}} and {{TAG|POMASS}} determine the valency and the atomic mass of each atomic species. It should be omitted usually since the values are read from the {{TAG|POTCAR}} file. If incompatibilities exist, VASP will stop. | ||
== Related Tags and Sections == | == Related Tags and Sections == | ||
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[[Category:INCAR]][[Category:Electronic | [[Category:INCAR tag]][[Category:POTCAR tag]][[Category:Electronic minimization]][[Category:Projector-augmented-wave method]] | ||
Revision as of 15:29, 6 April 2022
POMASS = [real]
Default: POMASS = values read from POTCAR
Description: POMASS describes the mass of each atomic sphere in atomic units.
ZVAL and POMASS determine the valency and the atomic mass of each atomic species. It should be omitted usually since the values are read from the POTCAR file. If incompatibilities exist, VASP will stop.