UPF format for SG15 PP v1.2
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mahe
- Posts: 1
- Joined: Wed Jul 13, 2016 1:20 am
UPF format for SG15 PP v1.2
The UPF format of SG15 PP v1.2 is desired for using them in codes like QE. Thanks!
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fgygi
- Site Admin
- Posts: 167
- Joined: Tue Jun 17, 2008 7:03 pm
Re: UPF format for SG15 PP v1.2
The SG15 potentials (version 1.2) in UPF format are now available at http://www.quantum-simulation.org/potentials/sg15_oncv/
The full collection is available as a compressed tar file http://www.quantum-simulation.org/poten ... -06.tar.gz
Please report any problem found with the potentials.
The full collection is available as a compressed tar file http://www.quantum-simulation.org/poten ... -06.tar.gz
Please report any problem found with the potentials.