LWAVE: Difference between revisions

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{{TAGDEF|LWAVE|[logical]|.NOT.{{TAG|LH5}}}}
{{TAGDEF|LWAVE|[logical]|.TRUE.}}


Description: {{TAG|LWAVE}} determines whether the wavefunctions are written to the {{FILE|WAVECAR}} file at the end of a run.
Description: Determines whether the wavefunctions are written at the end of a run.
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The wavefunctions are written to the {{FILE|WAVECAR}} file by default. If {{TAG|LH5|T}}, the wavefunctions are written to the {{FILE|vaspwave.h5}} instead.


== Related tags and articles ==
== Related tags and articles ==
{{TAG|LCHARG}}, {{TAG|LCHARGH5}}, {{TAG|LWAVEH5}}, {{TAG|LH5}}
{{FILE|WAVECAR}}, {{TAG|LH5}}, {{FILE|vaspwave.h5}}, {{TAG|LCHARG}}
 


{{sc|LWAVE|HowTo|Workflows that use this tag}}


{{sc|LWAVE|Examples|Examples that use this tag}}
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[[Category:INCAR tag]][[Category:Electronic minimization]][[Category:Projector-augmented-wave method]]
[[Category:INCAR tag]][[Category:Electronic minimization]][[Category:Projector-augmented-wave method]]

Latest revision as of 07:53, 11 March 2026

LWAVE = [logical]
Default: LWAVE = .TRUE. 

Description: Determines whether the wavefunctions are written at the end of a run.


The wavefunctions are written to the WAVECAR file by default. If LH5 = T, the wavefunctions are written to the vaspwave.h5 instead.

Related tags and articles

WAVECAR, LH5, vaspwave.h5, LCHARG


Workflows that use this tag