Superconducting Toolkit
Name | Size | Rev. | Time | Author | Log Message |
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.ci | |||||
COUPLE | |||||
CPV | |||||
Doc | |||||
EPW | |||||
FFTXlib | |||||
GUI | |||||
GWW | |||||
HP | |||||
KS_Solvers | |||||
LAXlib | |||||
LR_Modules | |||||
Modules | |||||
NEB | |||||
PHonon | |||||
PP | |||||
PW | |||||
PWCOND | |||||
PlotPhon | |||||
QHA | |||||
SCTK | |||||
TDDFPT | |||||
UtilXlib | |||||
XSpectra | |||||
archive | |||||
atomic | |||||
clib | |||||
dev-tools | |||||
dft-d3 | |||||
include | |||||
install | |||||
pseudo | |||||
test-suite | |||||
upftools | |||||
.editorconfig | 196 | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
.gitignore | 406 | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
.gitlab-ci.yml | 1.38 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
.travis.yml | 373 | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
CONTRIBUTING.md | 2.21 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
License | 17.59 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
Makefile | 13.16 k | c62d927 | 2019-10-31 13:20:18 | mitsuaki1987 | Merge remote-tracking branch 'remotes... |
README.md | 2.89 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
configure | 2.36 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
environment_variables | 3.3 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
logo.jpg | 41.74 k | 8c19445 | 2019-10-20 07:18:20 | Zack Gainsforth | Documentation for xanes_file card. R... |
This is the distribution of the Quantum ESPRESSO suite of codes (ESPRESSO: opEn-Source Package for Research in Electronic Structure, Simulation, and Optimization).
Quick installation instructions for the impatient:
./configure [options]
make all
("make" alone prints a list of acceptable targets). Binaries go in bin/. For more information, see the general documentation in directory Doc/, package-specific documentation in */Doc/, and the web site http://www.quantum-espresso.org/
The following libraries have been isolated and partially encapsulated in view of their release for usage in other codes as well:
Before contributing please read the Contribution Guidelines.
All the material included in this distribution 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 2 of the License, or (at your option) any later version.
These programs are distributed in the hope that they 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, write to the Free Software Foundation, Inc., 675 Mass Ave, Cambridge, MA 02139, USA.