[Wien] How to estimate the value of Ueff for f states using LDA + U

[Fecher, Gerhard]

Dear anonymous,
please READ on the Wien2k webpage the section "registered users"; WIEN2k-Textbooks: Notes about constraint LDA calculations to determine U by G. Madsen and P. Novak
do the same for the 4f states, that is done in the description for the d states. 


________________________________________
Von: Wien [wien-bounces at zeus.theochem.tuwien.ac.at] im Auftrag von Wien2k User [wien2k.user at gmail.com]
Gesendet: Mittwoch, 22. März 2017 12:36
An: wien at zeus.theochem.tuwien.ac.at
Betreff: [Wien] How to estimate the value of Ueff for f states using LDA + U

Dear Wien2k users,

How to estimate the value of Ueff for f states using LDA + U in the case wheneI have no experimental value.