Package: gpaw (23.9.1-1 and others)

[ Source: gpaw  ]

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.

Other Packages Related to gpaw

• dep: gpaw-data

  gpaw datasets/setups

• dep: libc6 (>= 2.14) [amd64]

  GNU C Library: Shared libraries
  also a virtual package provided by libc6-udeb

  dep: libc6 (>= 2.17) [arm64, ppc64el]

  dep: libc6 (>= 2.4) [not amd64, arm64, ppc64el]

• dep: libelpa19 (>= 2022.11.001)

  Eigenvalue SoLvers for Petaflop-Applications

• dep: libfftw3-double3 (>= 3.3.10)

  Library for computing Fast Fourier Transforms - Double precision

• dep: libopenmpi3 (>= 4.1.6)

  high performance message passing library -- shared library

• dep: libscalapack-openmpi2.2 (>= 2.2.1)

  Scalable Linear Algebra Package - Shared libs for OpenMPI

• dep: libxc9 (>= 5.0.0)

  Library of Exchange-Correlation Functionals

• dep: openmpi-bin

  high performance message passing library -- binaries

• dep: python3

  interactive high-level object-oriented language (default python3 version)

  dep: python3 (<< 3.13)

  dep: python3 (>= 3.11~)

• dep: python3-ase (>= 3.22.1)

  Atomic Simulation Environment (Python 3)

• dep: python3-numpy (>= 1:1.22.0)

  Fast array facility to the Python 3 language

• dep: python3-numpy-abi9

  virtual package provided by python3-numpy

• dep: python3-scipy

  scientific tools for Python 3

• dep: python3-yaml

  YAML parser and emitter for Python3

Download gpaw

Download for all available architectures

Architecture	Version	Package Size	Installed Size	Files
amd64	23.9.1-1+b1	1,381.8 kB	7,793.0 kB	[list of files]
arm64	23.9.1-1+b1	1,364.7 kB	7,760.0 kB	[list of files]
armel	23.9.1-1+b1	1,398.7 kB	7,905.0 kB	[list of files]
armhf	23.9.1-1+b1	1,349.4 kB	7,525.0 kB	[list of files]
i386	23.9.1-1+b1	1,369.8 kB	7,767.0 kB	[list of files]
mips64el	23.9.1-1+b1	1,363.8 kB	7,783.0 kB	[list of files]
ppc64el	23.9.1-1+b1	1,386.9 kB	7,889.0 kB	[list of files]
s390x	23.9.1-1+b1	1,382.2 kB	7,799.0 kB	[list of files]