LVHAR

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Revision as of 15:28, 15 February 2017 by Karsai (talk | contribs)

LVHAR = [logical]
Default: LVHAR = .FALSE. 

Description: This tag determines whether the total local potential (saved in the file LOCPOT contains the entire local potential (ionic + Hartree + exchange correlation) or the electrostatic contributions only (ionic + Hartree).


This tag is available in VASP.5.2.12 and newer version. Note that in VASP.5.2.12, the default is to write the entire local potential, including the exchange correlation potential.

Example Calculations using this Tag

Ni 111 surface high precision , partial DOS of CO on Ni 111 surface


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