scnc
/
abinit
mirror of https://github.com/abinit/abinit.git
1
0
Fork 0
Code Issues Packages Projects Releases Wiki Activity
abinit/tests/Pspdir/Psdj_paw_pw_stringent
History
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
..
Ba.xml 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.xml 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
Ti.xml 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 JTH v1.0 pseudopotentials have the same characteristics:

  • Same pseudopotential generator (Atompaw 4.0.0.12)

  • Same pseudopotential format (XML for PAW)

  • Same exchange-correlation functional (pspxc 7 , Perdew-Wang 1992)

  • Stringent accuracy

They have been downloaded on July 21, 2020 from the page http://www.pseudo-dojo.org/, with the settings PAW (JTH v1.0), LDA, stringent, xml