sci-physics/gpaw
GPAW is a density-functional theory (DFT) Python code based on the projector-augmented wave (PAW) method and the atomic simulation environment (ASE)
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gpaw-24.6.0~amd64+setups +fftw +blas_openblas +openmp mpi scalapack vdwxc elpa test python_targets_python3_11 python_targets_python3_12 debug
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Browse License: GPL-3 Overlay: phackerlay -
gpaw-24.1.0~amd64+setups +fftw +blas_openblas +openmp mpi scalapack vdwxc elpa test python_targets_python3_11 python_targets_python3_12 debug
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USE Flags
+setups
* This flag is undocumented *
+fftw
* This flag is undocumented *
+blas_openblas
* This flag is undocumented *
+openmp
* This flag is undocumented *
mpi
Global: Adds MPI (Message Passing Interface) layer to the apps that support it
scalapack
* This flag is undocumented *
vdwxc
* This flag is undocumented *
elpa
* This flag is undocumented *
test
Global: Workaround to pull in packages needed to run with FEATURES=test. Portage-2.1.2 handles this internally, so don't set it in make.conf/package.use anymore
python_targets_python3_11
* This flag is undocumented *
python_targets_python3_12
* This flag is undocumented *
debug
Global: Enable extra debug codepaths, like asserts and extra output. If you want to get meaningful backtraces see http://www.gentoo.org/proj/en/qa/backtraces.xml