Kaynak Paket: cp2k (2025.1-1.1)
cp2k için bağlantılar
Debian Kaynakları:
Geliştiriciler:
Dış Kaynaklar:
Aşağıdaki ikili paketler bu kaynak paketten inşa edilmiştir:
- cp2k
- Ab Initio Molecular Dynamics
- cp2k-data
- Ab Initio Molecular Dynamics (data files)
cp2k ile İlgili Diğer Paketler
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- bağımsız inşa bağımlılıkları
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bc
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bison
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debhelper
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- helper programs for debian/rules
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default-jre-headless
- Standard Java or Java compatible Runtime (headless)
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flex
- fast lexical analyzer generator
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python3
- interactive high-level object-oriented language (default python3 version)
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python3-lxml
- pythonic binding for the libxml2 and libxslt libraries
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python3-myst-parser
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python3-sphinxcontrib-mermaid
- Sphinx extension to embed Mermaid graphs in documents
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python3-sphinx-reredirects
- extension for Sphinx projects that handles redirects
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python3-sphinx-rtd-theme
- sphinx theme from readthedocs.org (Python 3)
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gfortran
- GNU Fortran 95 compiler
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libblas-dev
- Basic Linear Algebra Subroutines 3, static library
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libdbcsr-dev
(>= 2.6.0)
- Distributed Block Compressed Sparse Row matrix library
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libelpa-dev
(>= 2022.11.001-1)
- Eigenvalue SoLvers for Petaflop-Applications (Development version)
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libfftw3-dev
- Library for computing Fast Fourier Transforms - development
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libint2-dev
(>= 2.6.0-11)
- Computation Chemistry Integral Evaluation Library (development files)
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liblapack-dev
- Library of linear algebra routines 3 - static version
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libsaxonb-java
- Saxon-B XSLT Processor
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libscalapack-mpi-dev
(>= 2)
- Scalable Linear Algebra Package - Dev files for MPI
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libsymspg-dev
- C library for crystal symmetry determination (development files)
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libxc-dev
(>= 5.1.0)
- Library of Exchange-Correlation Functionals (development files)
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- adep:
mpi-default-dev
- Standard MPI development files (metapackage)
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- adep:
pkg-config
- manage compile and link flags for libraries (transitional package)
