POMASS: Difference between revisions

Revision as of 14:20, 7 February 2018

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, and should be omitted usually since the values are read from the POTCAR file. If incompatibilities exist, VASP will stop.

Related Tags and Sections

ZVAL

Examples that use this tag

Contents

Revision as of 12:58, 20 March 2017 (view source) Karsai (talk \| contribs) No edit summary ← Older edit		Revision as of 14:20, 7 February 2018 (view source) Karsai (talk \| contribs) No edit summary Newer edit →
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	{{TAGDEF\|POMASS\|[real]\|values read from {{TAG\|POTCAR}}}}}		{{TAGDEF\|POMASS\|[real]\|values read from {{TAG\|POTCAR}}}}

	Description: {{TAG\|POMASS}} describes the mass of each atomic sphere in atomic units.		Description: {{TAG\|POMASS}} describes the mass of each atomic sphere in atomic units.