Ergo, version 3.5, a program for linear scaling electronic structure
Copyright (C) 2016 Elias Rudberg, Emanuel H. Rubensson, Pawel Salek,
and Anastasia Kruchinina.
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),
For further information about Ergo, see <http://www.ergoscf.org>.