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Multiple sources in a single recipe
question
#20
opened May 2, 2018 by
mcbennet
updated May 14, 2018
Which pseudopotential formats are most useful and should be standardized?
enhancement
question
#18
opened Feb 28, 2018 by
prckent
updated Aug 16, 2019
Current ECPs require too high of plane wave cutoff
#55
opened Nov 21, 2019 by
lshulen
updated Dec 6, 2019
For which atoms are new pseudopotentials needed?
#56
opened Dec 6, 2019 by
prckent
updated Dec 13, 2019
XML files and UPF files have different reference states
#69
opened Dec 3, 2021 by
camelto2
updated Dec 3, 2021
Incorrect nelec in quantum chemistry-formatted "ccECP-soft" pseudopotentials
#84
opened Sep 16, 2022 by
djstaros
updated Oct 6, 2022
How to use "aug-cc-pVDZ-eCEPP.dat_Cu" in gaussian input?
#90
opened Apr 5, 2023 by
higinojr
updated Oct 10, 2023
How do convert a pseudopotential Cu.ccECP.xml in Cu_cpp.casino?
#93
opened Oct 9, 2023 by
higinojr
updated Oct 10, 2023
Naming convention error for DFT+U calculations in QE 7.1 for Fe.ccecp-soft.upf
#89
opened Mar 7, 2023 by
jptowns
updated Apr 19, 2024
Orbital Occupancy Discrepancies in Cu and Ag Pseudopotentials
#104
opened Apr 4, 2024 by
romanfanta4
updated Apr 19, 2024
xml and upf templates for Y and Nb are missing.
#112
opened Aug 8, 2024 by
Hyeondeok-Shin
updated Aug 8, 2024
Request for "Download all" button on Pseudopotential Library website
#113
opened Nov 21, 2024 by
djstaros
updated Dec 1, 2024
ProTip!
no:milestone will show everything without a milestone.