Sophie

Sophie

distrib > Fedora > 16 > i386 > by-pkgid > 37dc4c0a1ddd051c847ec1c7417a2231 > files > 7

ergo-3.2.1-1.fc16.i686.rpm

Ergo, version 3.2, a program for linear scaling electronic structure
calculations.
Copyright (C) 2012 Elias Rudberg, Emanuel H. Rubensson, and Pawel Salek.

This program is free software: you can redistribute it and/or modify
it under the terms of the GNU General Public License as published by
the Free Software Foundation, either version 3 of the License, or
(at your option) any later version.

This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the
GNU General Public License for more details.

You should have received a copy of the GNU General Public License
along with this program.  If not, see <http://www.gnu.org/licenses/>.

Primary academic reference:
Kohn−Sham Density Functional Theory Electronic Structure Calculations 
with Linearly Scaling Computational Time and Memory Usage,
Elias Rudberg, Emanuel H. Rubensson, and Pawel Salek,
J. Chem. Theory Comput. 7, 340 (2011),
<http://dx.doi.org/10.1021/ct100611z>

For further information about Ergo, see <http://www.ergoscf.org>.