Dear QE Users and Developers,
I have been trying to parse the soc psudopotential in upf format from
upftool in QE. I use read_ps.f90 and read_upf.f90. I use this
pseudopotential Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF
<https://www.quantum-espresso.org/upf_files/Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF>
I am beginner in Quantum Espresso. I can not read the file that crashes as
....
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine read_upf_tofile (1):
reading pseudo upf
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
could you help me how to rea upf pseudopotential and extract the
parameters. I am looking forward to get reply soon. Thank you!
--
Raj Kumar Paudel (Raj)
Graduate Student
Research Center for Applied Sciences,
516B Room, 5F, Interdisciplinary Research Building for Science and
Technology, Academia Sinica,
128 Academia Road, Section 2, Nankang, Taipei 115, Taiwan, R.O.C.
Cell: +886-966-440-750
Office: +886-2-2787-3196
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