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API
API
Relates to the API
5
bug
bug
11
build system
build system
1
C API
C API
Relates specifically to the C API
CI
CI
Continuous integration system
debugging
debugging
Relates to internal checking for bugs/failures
Documentation
Documentation
Change in the documentation of the code
1
duplicate
duplicate
enhancement
enhancement
56
Fortran API
Fortran API
Relates specifically to the Fortran API
GPU
GPU
Relates to GPU computation
Hamiltonian: DFTB
Hamiltonian: DFTB
Related to the Slater-Koster based tight-binding Hamiltonian
Hamiltonian: xTB
Hamiltonian: xTB
Related to the extended tight-binding Hamiltonian
5
help wanted
help wanted
invalid
invalid
library: negf
library: negf
Related to libnegf external dependency (transport)
1
library: s-dftd3
library: s-dftd3
Related to s-dftd3 external dependency (dispersion)
library: tblite
library: tblite
Related to tblite external dependency (xTB Hamiltonian)
1
MPI
MPI
Relates to distributed parallel
2
Packaging: condaforge
Packaging: condaforge
Poisson
Poisson
Poisson solver
preprocessor
preprocessor
Relates to preprocessing
Python API
Python API
Relates specifically to the Python API
2
question
question
regression tests
regression tests
Relates to regression tests
stale
stale
3
submodules
submodules
UI
UI
User interface
1
UX
UX
User experience
1
wontfix
wontfix