libint-dev_1.1.5-1_amd64.deb


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Description

libint-dev - Evaluate the integrals in modern atomic and molecular theory (devel)

Property Value
Distribution Debian 8 (Jessie)
Repository Debian Main amd64
Package name libint-dev
Package version 1.1.5
Package release 1
Package architecture amd64
Package type deb
Installed size 6.75 KB
Download size 1.44 MB
Official Mirror ftp.br.debian.org
The LIBINT library is used to evaluate the traditional (electron repulsion)
and certain novel two-body matrix elements (integrals) over Cartesian
Gaussian functions used in modern atomic and molecular theory. The idea
of the library is to let computer write optimized code for computing
such integrals. There are two primary advantages to this: much less
human effort is required to write code for computing new integrals, and
code can be optimized specifically for a particular computer
architecture (e.g., vector processor).
LIBINT has been utilized to implement methods such as Hartree-Fock (HF)
and Kohn-Sham density functional theory (KS DFT), second-order
Moeller-Plesset perturbation theory (MP2), coupled cluster singles and
doubles (CCSD) method, as well as explicitly correlated R12 methods.
This package contains the development header files.

Alternatives

Package Version Architecture Repository
libint-dev_1.1.5-1_i386.deb 1.1.5 i386 Debian Main
libint-dev - - -

Requires

Name Value
libint1 = 1.1.5-1

Download

Type URL
Binary Package libint-dev_1.1.5-1_amd64.deb
Source Package libint

Install Howto

  1. Update the package index:
    # sudo apt-get update
  2. Install libint-dev deb package:
    # sudo apt-get install libint-dev

Files

Path
/usr/include/libderiv/libderiv.h
/usr/include/libint/hrr_header.h
/usr/include/libint/libint.h
/usr/include/libint/vrr_header.h
/usr/include/libr12/libr12.h
/usr/lib/libderiv.a
/usr/lib/libderiv.so
/usr/lib/libint.a
/usr/lib/libint.so
/usr/lib/libr12.a
/usr/lib/libr12.so
/usr/share/doc-base/libint-dev
/usr/share/doc/libint-dev/changelog.Debian.gz
/usr/share/doc/libint-dev/changelog.gz
/usr/share/doc/libint-dev/copyright
/usr/share/doc/libint-dev/progman.pdf.gz

Changelog

2013-05-26 - Debichem Team <debichem-devel@lists.alioth.debian.org>
libint (1.1.5-1) unstable; urgency=low
[ Daniel Leidert ]
* New upstream release.
* debian/control: Dropped DM-Upload-Allowed.
(Uploaders): Removed myself.
(Standards-Version): Bumped to 3.9.4.
(Build-Depends): Added texlive-font-utils for pslatex.
* debian/copyright: Updated and rewritten in dep5 format.
* debian/libint1.lintian-overrides: Added.
* debian/libint-dev.doc-base: Fixed doc-base-uses-applications-section.
* debian/rules: Enable hardening and parallel mode. Install changelog.
(override_dh_configure): Set shell to bash.
* debian/upstream: Added.
* debian/watch: Fixed.
* debian/patches/01_fix_doc_makefile.patch: Renamed to
debian/patches/fix_doc_makefile.patch.
* debian/patches/enable_hardening.patch: Added.
- Fix build with hardening flags enabled.
* debian/patches/fix_makefiles.patch: Added.
- Enable LDFLAGS for libraries.
* debian/patches/series: Adjusted.
2012-02-12 - Michael Banck <mbanck@debian.org>
libint (1.1.4-1) unstable; urgency=low
* Initial upload (Closes: #425039).

See Also

Package Description
libint1_1.1.5-1_amd64.deb Evaluate the integrals in modern atomic and molecular theory
libinternals-perl_1.1-2+b1_amd64.deb Perl module for write-protecting variables and manipulating refcounts
libintl-perl_1.23-1+deb8u1_all.deb Uniforum message translations system compatible i18n library
libintl-xs-perl_1.23-1+deb8u1_amd64.deb Uniforum message translations system compatible i18n library
libinventor1_2.1.5-10-18+b2_amd64.deb Open Inventor runtime environment
libio-aio-perl_4.31-1+b1_amd64.deb asynchronous IO module for Perl
libio-all-lwp-perl_0.14-1_all.deb Perl module to use HTTP and FTP URLs with IO::All
libio-all-perl_0.79-1_all.deb Perl module for unified IO operations
libio-async-loop-epoll-perl_0.16-1_all.deb Perl extension for an event loop using epoll
libio-async-loop-glib-perl_0.21-1_all.deb Perl extension for an event loop using GLib
libio-async-perl_0.64-1_all.deb module providing asynchronous filehandle I/O
libio-bufferedselect-perl_1.0-1_all.deb Perl module for line-buffered select interface
libio-callback-perl_1.12-2_all.deb emulate file interface for a code reference
libio-capture-perl_0.05-3_all.deb Abstract Base Class to build modules to capture output
libio-captureoutput-perl_1.1103-1_all.deb module for capturing STDOUT and STDERR from Perl code, subprocesses or XS
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