v0.12.0
QuantumESPRESSOBase v0.12.0
Merged pull requests:
- CompatHelper: bump compat for Spglib to 0.7, (keep existing compat) (#211) (@github-actions[bot])
- CompatHelper: bump compat for CrystallographyBase to 0.11, (keep existing compat) (#212) (@github-actions[bot])
- CompatHelper: bump compat for CrystallographyBase to 0.12, (keep existing compat) (#213) (@github-actions[bot])
- CompatHelper: bump compat for Spglib to 0.8, (keep existing compat) (#214) (@github-actions[bot])
- Bump actions/checkout from 3 to 4 (#215) (@dependabot[bot])
- CompatHelper: bump compat for CrystallographyBase to 0.13, (keep existing compat) (#216) (@github-actions[bot])
- CompatHelper: bump compat for CrystallographyBase to 0.14, (keep existing compat) (#217) (@github-actions[bot])
- Redefine
ReciprocalPoint
toSpecialPoint
(#218) (@singularitti) - Deprecate
CartesianFromFractional
, use the new API (#219) (@singularitti) - Replace
Setfield.@set!
withAccessors.@reset
(#220) (@singularitti) - CompatHelper: add new compat entry for Accessors at version 0.1, (keep existing compat) (#221) (@github-actions[bot])
- Move code from src/PWscf/crystallography.jl to ext/ChemicalFormulaExt.jl (#222) (@singularitti)
- Add extension
StructTypesExt
(#223) (@singularitti) - Move
find_symmetry
from src/PWscf/crystallography.jl to ext/CrystallographyExt.jl (#224) (@singularitti) - Fix cards (#226) (@singularitti)
- Move code to ext/UnitfulExt.jl & ext/UnitfulEquivalencesExt.jl (#227) (@singularitti)
- Make all
Card
's options to beSymbol
s, notString
s (#228) (@singularitti) - Fix leftover
option
ingetoption
(#229) (@singularitti) - Replace
listpotentials
witheachpotential
, Extendeachatom
(#230) (@singularitti) - CompatHelper: add new compat entry for CrystallographyCore at version 0.5, (keep existing compat) (#231) (@github-actions[bot])
- CompatHelper: bump compat for CrystallographyCore to 0.6, (keep existing compat) (#232) (@github-actions[bot])