Package: wnpp
Severity: wishlist
* Package name : pslibrary
Version : 1.0.0
Upstream Author : Andrea Dal Corso
* URL : https://dalcorso.github.io/pslibrary/
* License : GPL-2+
Description : library of ultrasoft and PAW pseudopotentials
PSlibrary is a library of scalar relativistic and fully relativistic PAW data
sets and ultrasoft pseudopotentials for many elements in Unified
Pseudopotential Format (UPF).
PSlibrary paper [1] is widely cited (with ~60 citations during year 2018) [2].
The package consists of pseudopotentials built using Quantum ESPRESSO from
upstream-supplied inputs, resulting in ~3 GB of pseudopotential files (~700 MB
when compressed).
I plan to maintain the package inside the Debichem team.
[1] http://authors.elsevier.com/sd/article/S0927025614005187
[2] https://scholar.google.lt/scholar?as_ylo=2018&hl=en&as_sdt=2005&sciodt=0,5&cites=8672732540737765863&scipsc=
--
Andrius Merkys
Vilnius University Institute of Biotechnology, Saulėtekio al. 7, room V325
LT-10257 Vilnius, Lithuania