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Fedora 11 Update: libint-1.1.4-1.fc11



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Fedora Update Notification
FEDORA-2009-6393
2009-06-15 22:07:09
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Name        : libint
Product     : Fedora 11
Version     : 1.1.4
Release     : 1.fc11
URL         : http://www.files.chem.vt.edu/chem-dept/valeev/software/libint/libint.html
Summary     : A library that evaluates integrals over Gaussian basis functions
Description :
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 Moller-Plesset
perturbation theory (MP2), coupled cluster singles and doubles (CCSD)
method, as well as explicitly correlated R12 methods.

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Update Information:

First release in Fedora.
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ChangeLog:

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References:

  [ 1 ] Bug #502621 - Review Request: libint - A library that evaluates integrals over Gaussian basis functions
        https://bugzilla.redhat.com/show_bug.cgi?id=502621
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This update can be installed with the "yum" update program.  Use 
su -c 'yum update libint' at the command line.
For more information, refer to "Managing Software with yum",
available at http://docs.fedoraproject.org/yum/.

All packages are signed with the Fedora Project GPG key.  More details on the
GPG keys used by the Fedora Project can be found at
http://fedoraproject.org/keys
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