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different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
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CP2K does not implement Car-Parinello Molecular Dynamics (CPMD).

This package contains the non-MPI single process and multi-threaded versions.</description>
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CP2K is a freely available (GPL) program, written in Fortran 95, to
perform atomistic and molecular simulations of solid state, liquid,
molecular and biological systems. It provides a general framework for
different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
many-body potentials.

CP2K does not implement Car-Parinello Molecular Dynamics (CPMD).

This package contains the non-MPI single process and multi-threaded versions.</description>
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CP2K is a freely available (GPL) program, written in Fortran 95, to
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molecular and biological systems. It provides a general framework for
different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
many-body potentials.

CP2K does not implement Car-Parinello Molecular Dynamics (CPMD).

This package contains the documentation and the manual.</description>
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  <description>This package provides debug information for package cp2k.
Debug information is useful when developing applications that use this
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  <description>This package provides debug sources for package cp2k.
Debug sources are useful when developing applications that use this
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  <description>
CP2K is a freely available (GPL) program, written in Fortran 95, to
perform atomistic and molecular simulations of solid state, liquid,
molecular and biological systems. It provides a general framework for
different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
many-body potentials.

CP2K does not implement Car-Parinello Molecular Dynamics (CPMD).

This package contains the parallel single- and multi-threaded versions
using mpich.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
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  <summary>Debug information for package cp2k-mpich</summary>
  <description>This package provides debug information for package cp2k-mpich.
Debug information is useful when developing applications that use this
package or when debugging this package.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
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    <file>/usr/lib/debug/usr/lib64/mpich/bin/grid_miniapp.psmp-2026.2-1.fc45.aarch64.debug</file>
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  <summary>Development files for cp2k</summary>
  <description>The cp2k-devel package contains libraries and header files for
developing applications that use cp2k.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
  <time file="1784114106" build="1784111488"/>
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<package type="rpm">
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  <summary>Molecular simulations software - openmpi version</summary>
  <description>
CP2K is a freely available (GPL) program, written in Fortran 95, to
perform atomistic and molecular simulations of solid state, liquid,
molecular and biological systems. It provides a general framework for
different methods such as e.g. density functional theory (DFT) using a
mixed Gaussian and plane waves approach (GPW), and classical pair and
many-body potentials.

CP2K does not implement Car-Parinello Molecular Dynamics (CPMD).

This package contains the parallel single- and multi-threaded versions
using OpenMPI.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
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  <description>This package provides debug information for package cp2k-openmpi.
Debug information is useful when developing applications that use this
package or when debugging this package.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
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  <summary>Development files for cp2k</summary>
  <description>The cp2k-devel package contains libraries and header files for
developing applications that use cp2k.</description>
  <packager></packager>
  <url>https://www.cp2k.org/</url>
  <time file="1784114215" build="1784111488"/>
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DBCSR stands for Distributed Blocked Compressed Sparse Row.

DBCSR is a library designed to efficiently perform sparse matrix-matrix
multiplication, among other operations.  It is MPI and OpenMP parallel and
can exploit Nvidia and AMD GPUs via CUDA and HIP.

This package contains the non-MPI single process and multi-threaded versions.</description>
  <packager></packager>
  <url>https://cp2k.github.io/dbcsr/develop/</url>
  <time file="1782563673" build="1782563146"/>
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DBCSR stands for Distributed Blocked Compressed Sparse Row.

DBCSR is a library designed to efficiently perform sparse matrix-matrix
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This package contains the non-MPI single process and multi-threaded versions.</description>
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DBCSR is a library designed to efficiently perform sparse matrix-matrix
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can exploit Nvidia and AMD GPUs via CUDA and HIP.

This package contains the parallel single- and multi-threaded versions
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DBCSR is a library designed to efficiently perform sparse matrix-matrix
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This package contains the parallel single- and multi-threaded versions
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