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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

    View      Download      Browse     License: GPL-2   
    Overlay: phackerlay

USE Flags

+system-blas
* This flag is undocumented *
+system-fftw
* This flag is undocumented *
+system-lapack
* This flag is undocumented *
+libxc
* This flag is undocumented *
hdf5
Global: Adds support for the Hierarchical Data Format v5
openmp
Global: Build support for the OpenMP (support parallel computing), requires >=sys-devel/gcc-4.2 built with USE="openmp"
mpi
Global: Adds MPI (Message Passing Interface) layer to the apps that support it
elpa
* This flag is undocumented *
scalapack
* This flag is undocumented *