libint-1.1.4-alt1_11.x86_64.rpm


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Description

libint - A library for computing electron repulsion integrals efficiently

Distribution: ALT Linux Sisyphus
Repository: Classic x86_64
Package name: libint
Package version: 1.1.4
Package release: alt1_11
Package architecture: x86_64
Package type: rpm
Installed size: 18.38 MB
Download size: 18.38 MB
Official Mirror: ftp.altlinux.org
LIBINT computes the Coulomb and exchange integrals, which in electronic structure theory are called electron repulsion integrals (ERIs). This is by far the most common type of integrals in molecular structure theory. LIBINT uses recursive schemes that originate in seminal Obara-Saika method and Head-Gordon and Poplea.'s variation thereof. The idea of LIBINT is to optimize computer implementation of such methods by implementing an optimizing compiler to generate automatically highly-specialized code that runs well on super-scalar architectures.

Alternatives

Requires

Provides

  • libint = 1.1.4-alt1_11
  • libint-stable.so.1()(64bit)

    Download

    Install Howto

    1. Add the following line to /etc/apt/sources.list:
      rpm [Sisyphus] http://ftp.altlinux.org/pub/distributions/ALTLinux/Sisyphus x86_64 classic
      rpm [Sisyphus] http://ftp.altlinux.org/pub/distributions/ALTLinux/Sisyphus noarch classic
      
    2. Update the package index:
      # sudo apt-get update
    3. Install libint rpm package:
      # sudo apt-get install libint

    Files

    • /usr/lib64/libint-stable.so.1
    • /usr/lib64/libint-stable.so.1.0.0
    • /usr/share/doc/libint-1.1.4/LICENSE

    Changelog

    2013-02-24 - Igor Vlasenko <viy@altlinux.ru> 1.1.4-alt1_11 - update to new release by fcimport

    2013-01-16 - Igor Vlasenko <viy@altlinux.ru> 1.1.4-alt1_9 - initial fc import

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