Many thanks, Giuseppe. In fact I have downloaded the complete
sg15_oncv_upf_2020-02-06.tar.gz file, as I might need other pseudos with
spin-orbit
José C. Conesa
El 09/08/2020 a las 13:34, Giuseppe Mattioli escribió:
Dear José
You may try here, FR stands for "fully relativistic"
Dear José
You may try here, FR stands for "fully relativistic"
http://www.quantum-simulation.org/potentials/sg15_oncv/upf/
HTH
Giuseppe
Quoting José Carlos Conesa Cegarra :
Hi all,
Could anyone provide a norm-conserving pseudopotential for Pb which
has been computed including spinorbit
Hi all,
Could anyone provide a norm-conserving pseudopotential for Pb which has
been computed including spinorbit coupling?
--
José C. Conesa
Research Professor
Instituto de Catálisis y Petroleoquímica, CSIC
Marie Curie, 2; Campus de Cantoblanco
28028 Madrid (Spain)
Telef. +34 915854766
