Releases: MineralsCloud/AbInitioSoftwareBase.jl
Releases · MineralsCloud/AbInitioSoftwareBase.jl
v0.8.0
AbInitioSoftwareBase v0.8.0
Merged pull requests:
- New version: v0.7.1 (#63) (@singularitti)
- CompatHelper: bump compat for Configurations to 0.17, (keep existing compat) (#64) (@github-actions[bot])
- Add interface functions
getpotentials
&getpseudodir
(#65) (@singularitti)
v0.7.1
AbInitioSoftwareBase v0.7.1
Merged pull requests:
- New version: v0.7.0 (#61) (@singularitti)
- Add method
set_path
(#62) (@singularitti)
v0.7.0
AbInitioSoftwareBase v0.7.0
Merged pull requests:
- New version: v0.6.0 (#55) (@singularitti)
- Move
MpiexecOptions.path
to a global preference (#56) (@singularitti) - Move
MpiexecOptions.path
to a global preference (#57) (@singularitti) - Deprecate type
MpiexecOptions
&MpiexecConfig
& Rewritempiexec
(#58) (@singularitti) - Remove docs of
MpiexecConfig
& Add Preferences.jl to docs (#59) (@singularitti) - Fix tests in #52 (#60) (@singularitti)
v0.6.0
AbInitioSoftwareBase v0.6.0
Merged pull requests:
- Add
path
&env
toMpiexecOptions
& Remove MPICH_jll.jl from deps (#54) (@singularitti)
v0.5.2
AbInitioSoftwareBase v0.5.2
Merged pull requests:
- New version: v0.5.1 (#51) (@singularitti)
- Fix
Dict
type of loading YAML files to beDict{String,Any}
(#52) (@singularitti)
v0.5.1
v0.5.0
AbInitioSoftwareBase v0.5.0
Merged pull requests:
- Add more args in
MpiexecOptions
& useCompat.addenv
(#47) (@singularitti) - Fix docs of
MpiexecOptions
&mpiexec
(#48) (@singularitti) - Fix formatting of
hosts
& other args (#49) (@singularitti)
v0.4.0
AbInitioSoftwareBase v0.4.0
Closed issues:
- Register v0.3.0 (#43)
Merged pull requests:
- Redefine
MpiexecConfig
&mpiexec
(#44) (@singularitti)
v0.3.0
AbInitioSoftwareBase v0.3.0
Closed issues:
- Register v0.2.1 (#41)
Merged pull requests:
- Implement iteration interface for
Namelist
s (#42) (@singularitti)