JuliaMolSim/DFTK.jl: v0.5.6
- Michael F. Herbst
- Antoine Levitt
- Gaspard Kemlin
- Niklas Schmitz
- Étienne Polack
- Chuin Wei Tan
- Jae-Mo Lihm
- ssirajdine
- Jeremiah DeGreeff
- Anant Thazhemadam
- Austin Zadoks
- Deeptendu Santra
- Eric Berquist
- Gabriel Birnbaum
- cyborg1995
- Harmen Stoppels
- Harry LaBollita
- Kevin Octavian
- Laurent Vidal
- Louis Ponet
- tzsuzsi
Publication date
August 2022
DOIAbstract
DFTK v0.5.6 Diff since v0.5.5 Closed issues: Overly excessive n_bands by default for spin-polarised calculations (#692) Merged pull requests: DFTK Juliacon demo code (#677) (@mtowara) Overhaul docs organisation (#684) (@antoine-levitt) Reduce default number of bands for spin-polarised (#693) (@mfherbst) Fix dual handling for parametrised functionals (#699) (@mfherbst) Typo in dos.jl (#702) (@gkemlin) Zygote scf merge (#705) (@mtowara) Update to next spglib (#707) (@mfherbst
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