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abinit/tests/Pspdir/Psdj_nc_sr_04_pw_std_psp8
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trunk 16a818a670 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
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Al.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
As.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Au.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
B.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Ba.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
C.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
F.upf Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Fe.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Ga.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
H.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Li.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Mg-low.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Mg.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
N.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
O.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
P.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Pb.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
README.md Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Si.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00
Ti.psp8 Replace Pseudodojo_ by Psdj_ and _standard by _std for the pseudodojo name in the tests directory. 2024-11-20 18:54:40 +01:00

README.md

Information about the pseudopotentials in this directory

These pseudodojo NC-SR v0.4 pseudopotentials have the same characteristics:

  • Same pseudopotential generator (ONCVPSP-3.3.0)

  • Same pseudopotential format (pspcod 8)

  • Same exchange-correlation functional (pspxc -1012 , PW - Perdew-Wang LDA)

  • Standard accuracy

Most have been downloaded on July 21, 2020 from the page http://www.pseudo-dojo.org/, with the settings NC SR (ONCVPSP v0.4), LDA, standard, psp8

The O.psp8 has been downloaded on September 26, 2020 from Github https://github.com/abinit/pseudo_dojo/blob/master/pseudo_dojo/pseudos/ONCVPSP-PW-PDv0.4/O/O.psp8 At that time, it was not available on the pseudodojo Web site.