LDA NC PPs

[XiongyiLIANG]

Dear all,

Could anyone please give me LDA+NC pseudopotentials that works for QERaman? Many thansk.

Best regards,
LIANG
City University of Hong Kong

[nguyen-group]

Hi Liang,

QERaman can work with any LDA+NC pseudopotential library.
For me, I often use Hartwigesen-Goedecker-Hutter pseudopotential from here: https://pseudopotentials.quantum-espresso.org/legacy_tables/hartwigesen-goedecker-hutter-pp

Best,
Nguyen

[XiongyiLIANG]

Thanks very much