LDAUL: Difference between revisions
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== Example Calculations using this Tag == | == Example Calculations using this Tag == | ||
{{TAG|NiO LSDA+U}} | {{TAG|Constraining the local magnetic moments}}, {{TAG|Determining the Magnetic Anisotropy}}, {{TAG|Estimation of J magnetic coupling}}, {{TAG|Including the Spin-Orbit Coupling}}, {{TAG|NiO GGA+U}}, {{TAG|NiO LSDA+U}} | ||
---- | ---- | ||
[[The_VASP_Manual|Contents]] | [[The_VASP_Manual|Contents]] | ||
[[Category:INCAR]][[Category:LDA+U]] | [[Category:INCAR]][[Category:LDA+U]] | ||
Revision as of 10:06, 24 February 2017
LDAUL = [integer array]
Default: LDAUL = NTYP*2
Description: LDAUL specifies the l-quantum number for which the on-site interaction is added.
For LDAUL=-1 no on-site interaction is added.
Mind: one has to specify one number for each atomic species.
Related Tags and Sections
LDAU, LDAUTYPE, LDAUU, LDAUJ, LDAUPRINT
Example Calculations using this Tag
Constraining the local magnetic moments, Determining the Magnetic Anisotropy, Estimation of J magnetic coupling, Including the Spin-Orbit Coupling, NiO GGA+U, NiO LSDA+U