Kaynak Paket: cp2k (2025.1-1.1)

cp2k için bağlantılar

• Debian Kaynak Deposu (Git)
• eLxr Yama Takipçisi

Geliştiriciler:

• Debichem Team
• Michael Banck

Dış Kaynaklar:

• Ana Sayfa [www.cp2k.org]

cp2k

Ab Initio Molecular Dynamics

cp2k-data

Ab Initio Molecular Dynamics (data files)

cp2k ile İlgili Diğer Paketler

• adep: bc

  GNU bc arbitrary precision calculator language

• adep: bison

  YACC-compatible parser generator

• adep: debhelper (>= 10)

  helper programs for debian/rules

• adep: default-jre-headless

  Standard Java or Java compatible Runtime (headless)

• adep: flex

  fast lexical analyzer generator

• adep: python3

  interactive high-level object-oriented language (default python3 version)

• adep: python3-lxml

  pythonic binding for the libxml2 and libxslt libraries

• adep: python3-myst-parser

  rich and extensible flavor of Markdown for technical docs

• adep: python3-sphinxcontrib-mermaid

  Sphinx extension to embed Mermaid graphs in documents

• adep: python3-sphinx-reredirects

  extension for Sphinx projects that handles redirects

• adep: python3-sphinx-rtd-theme

  sphinx theme from readthedocs.org (Python 3)

• adep: gfortran

  GNU Fortran 95 compiler

• adep: libblas-dev

  Basic Linear Algebra Subroutines 3, static library

• adep: libdbcsr-dev (>= 2.6.0)

  Distributed Block Compressed Sparse Row matrix library

• adep: libelpa-dev (>= 2022.11.001-1)

  Eigenvalue SoLvers for Petaflop-Applications (Development version)

• adep: libfftw3-dev

  Library for computing Fast Fourier Transforms - development

• adep: libint2-dev (>= 2.6.0-11)

  Computation Chemistry Integral Evaluation Library (development files)

• adep: liblapack-dev

  Library of linear algebra routines 3 - static version

• adep: libsaxonb-java

  Saxon-B XSLT Processor

• adep: libscalapack-mpi-dev (>= 2)

  Scalable Linear Algebra Package - Dev files for MPI

• adep: libsymspg-dev

  C library for crystal symmetry determination (development files)

• adep: libxc-dev (>= 5.1.0)

  Library of Exchange-Correlation Functionals (development files)

• adep: mpi-default-dev

  Standard MPI development files (metapackage)

• adep: pkg-config

  manage compile and link flags for libraries (transitional package)

Download cp2k

Debian Paket Kaynak Deposu (VCS: Git)

https://salsa.debian.org/debichem-team/cp2k.git

Debian Paket Kaynak Deposu (Gezinilebilir)

https://salsa.debian.org/debichem-team/cp2k