Published August 15, 2023
| Version v0.6.10
Software
Open
DFTK: The Density-functional toolkit
- 1. École Polytechnique Federale Lausanne
- 2. Inria Paris
- 3. CERMICS, Ecole des Ponts
Description
DFTK v0.6.10
Closed issues:
- Switch to ReTest (#508)
- Unexpected error when using Crystallographic Information Framework (CIF) File Input (#863)
Merged pull requests:
- API change for Ewald and pairwise computations (#853) (@epolack)
- Extend details on precompilation and developer setup (#862) (@mfherbst)
- Parse element by number (#864) (@mfherbst)
- Fix GPU CI (again) (#865) (@mfherbst)
- Fix GPU tests (#867) (@vchuravy)
- Fix for Ewald (#869) (@epolack)
- CompatHelper: bump compat for Spglib to 0.7, (keep existing compat) (#870) (@github-actions[bot])
- Collection of some documentation extensions and bugfixes (#873) (@mfherbst)
Notes
Files
JuliaMolSim/DFTK.jl-v0.6.10.zip
Files
(893.1 kB)
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Additional details
Related works
- Is supplement to
- https://github.com/JuliaMolSim/DFTK.jl/tree/v0.6.10 (URL)