Source: gpaw
Maintainer: Debichem Team <debichem-devel@lists.alioth.debian.org>
Uploaders: Marcin Dulak <Marcin.Dulak@gmail.com>,
           Graham Inggs <ginggs@debian.org>
Section: science
Priority: optional
Build-Depends: debhelper-compat (= 13),
               dh-python,
               gpaw-data,
               libblas-dev,
               libelpa-dev (>= 2017.12.01),
               libfftw3-dev,
               libscalapack-mpi-dev (>= 2.0.2),
               libxc-dev,
               mpi-default-dev,
               python3-all-dev,
               python3-ase (>= 3.21.0),
               python3-numpy,
               python3-pytest,
               python3-scipy,
               python3-setuptools
Standards-Version: 4.5.1
Rules-Requires-Root: no
Vcs-Browser: https://salsa.debian.org/debichem-team/gpaw
Vcs-Git: https://salsa.debian.org/debichem-team/gpaw.git
Homepage: https://wiki.fysik.dtu.dk/gpaw/

Package: gpaw
Architecture: any
Depends: gpaw-data,
         openmpi-bin,
         python3-ase (>= 3.21.0),
         python3-scipy
         ${misc:Depends},
         ${python3:Depends},
         ${shlibs:Depends}
Description: DFT and beyond within the projector-augmented wave method
 A density-functional theory (DFT) Python code
 based on the projector-augmented wave (PAW) method and the
 atomic simulation environment (ASE). It uses real-space uniform grids and
 multigrid methods, atom-centered basis-functions or plane-waves.