sci-physics/quantum-espresso
Suite for first-principles electronic-structure calculations and materials modeling
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quantum-espresso-7.4~amd64+system-blas +system-fftw +system-lapack +libxc hdf5 openmp mpi elpa scalapack
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Browse License: GPL-2 Overlay: phackerlay
Runtime Dependencies
quantum-espresso-7.4
system-blas?
( virtual/blas[eselect-ldso] )
system-lapack?
( virtual/lapack[eselect-ldso] )
system-fftw?
( sci-libs/fftw[fortran] )
mpi?
( virtual/mpi[fortran,threads] system-fftw?
( sci-libs/fftw[mpi] )
)
scalapack?
( sci-libs/scalapack )
hdf5?
( sci-libs/hdf5[fortran] )
openmp?
( sys-devel/gcc[openmp] system-fftw?
( sci-libs/fftw[openmp] )
)
libxc?
( >=sci-libs/libxc-5.1.2[fortran] )
elpa?
( sci-libs/elpa openmp?
( sci-libs/elpa[openmp] )
mpi?
( sci-libs/elpa[mpi] )
)