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LWAVEH5: Difference between revisions

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Created page with "{{TAGDEF|LWAVE|[logical]|{{TAG|LH5}}}} Description: {{TAG|LWAVEH5}} determines whether the wavefunctions are written to {{FILE|vaspwave.h5}} file at the end of a run. == Rel..."
 
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{{TAGDEF|LWAVE|[logical]|{{TAG|LH5}}}}
{{TAGDEF|LWAVEH5|[logical]|{{TAG|LH5}}}}


Description: {{TAG|LWAVEH5}} determines whether the wavefunctions are written to {{FILE|vaspwave.h5}} file at the end of a run.
Description: Determines whether the wavefunctions are written to {{FILE|vaspwave.h5}} file at the end of a run.
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If {{TAG|LWAVEH5|True}}, the Kohn-Sham orbitals, i.e., wavefunctions, are written to the {{FILE|vaspwave.h5}} file at the end of the calculation. This can be used to restart VASP.
{{NB|deprecated|{{TAG|LWAVEH5}} is deprecated as of VASP 6.4.3 and is not read/used by the code. It was introduced in VASP 6.1.0.}}


== Related tags and articles ==
== Related tags and articles ==
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{{sc|LWAVEH5|Examples|Examples that use this tag}}
{{sc|LWAVEH5|Examples|Examples that use this tag}}
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[[Category:INCAR tag]][[Category:Electronic minimization]][[Category:PAW]]
 
[[Category:INCAR tag]]

Latest revision as of 08:42, 11 March 2026

LWAVEH5 = [logical]
Default: LWAVEH5 = LH5 

Description: Determines whether the wavefunctions are written to vaspwave.h5 file at the end of a run.


If LWAVEH5 = True, the Kohn-Sham orbitals, i.e., wavefunctions, are written to the vaspwave.h5 file at the end of the calculation. This can be used to restart VASP.

Related tags and articles

LCHARG, LCHARGH5, LWAVE, LH5


Examples that use this tag