Information about the package, libint, which is shipped with common Linux distributions. The libint package is designed for, A library for computing electron repulsion integrals efficiently.
Package Name:
libint
Summary:
A library for computing electron repulsion integrals efficiently
Description:
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 Pople’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.
Architecture:
x86_64
Version:
1.2.1
Release:
2.el6
Size:
32 M
Repository:
epel
From Repository:
Licence:
LGPLv3
Control the libint package with the following handy commands outlined below.
yum install libint
This command will install libint on the server.
yum remove libint
This command will un-install libint on the server. When you run this command, you will be asked if you are sure that you want to remove libint, so you have to manually confirm that you want to do this.
yum -y remove libint
This command will un-install libint on the server. When you run this command with th e -y flag, you will not be prompted to check that you are sure you want to remove the package - so be sure you absolutely want to remove libint when using the -y flag.
yum update libint
This command will update libint to the latest version. When you run this command, you will be asked if you are sure that you want to remove libint, so you have to manually confirm that you want to do this.
yum -y update libint
This command will update libint to the latest version. When you run this command with the -y flag, you will not be prompted to check that you are sure you want to remove the package - so be sure you absolutely want to remove libint when using the -y flag.
yum info libint
This command will show you core information about the libint package.
yum deplist libint
This command will show you the dependencies for libint. Thankfully, when using Yum, if dependencies are required, these are also installed at the same time so you don't have to worry too much about that.
yum check-update libint
This command will check if there is an update waiting on libint. When you run this command this will return nothing if there is nothing to update, or, will return the package name if the package is due to be updated.