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This repository is version 1 of QP. This version is not supported any more. Version 2 is available here : https://github.com/QuantumPackage/qp2
711 Commits 6 Branches 5 Tags 93 MiB
Fortran 80.5%
OCaml 9.4%
Python 5.5%
Forth 3.5%
Shell 0.8%
Other 0.1%
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Thomas Applencourt a48f089990 Better config_gfortran
2015-05-27 17:50:51 +02:00
bin Improved setup scripts to auto-install curl and m4 2014-10-23 22:40:21 +02:00
config Better config_gfortran 2015-05-27 17:50:51 +02:00
data n_det_max in in dets, and PT2_max and var_pt2_max are in Perturbation. Delete all the multiple occurance 2015-05-12 15:14:54 +02:00
doc Added documentation and Makefile 2014-04-01 18:21:01 +02:00
include Installation of zlib 2015-01-12 19:14:00 +01:00
lib Installation of zlib 2015-01-12 19:14:00 +01:00
ocaml Fix for travis (add Read_compilation) 2015-05-26 16:09:09 +02:00
scripts Better config_gfortran 2015-05-27 17:50:51 +02:00
src Remove makefile.depend dependancy ! 2015-05-27 11:02:13 +02:00
tests n_det_max in in dets, and PT2_max and var_pt2_max are in Perturbation. Delete all the multiple occurance 2015-05-12 15:14:54 +02:00
.gitattributes Added gitattributes 2015-04-02 12:30:34 +02:00
.gitignore Add *.mod and *.p in gitignore 2015-03-26 20:34:02 +01:00
.travis.yml Better config_gfortran 2015-05-27 17:50:51 +02:00
INSTALL.md Change image name, add image in README.rst, and add Graphviz in dependancy 2015-05-12 10:39:49 +02:00
LICENSE Initial commit 2014-04-01 02:24:45 -07:00
Makefile Change veryclean to delete resultfile 2015-05-04 16:07:53 +02:00
README.md Update README.md 2015-03-25 11:31:42 +01:00
setup_environment.sh Add ninja instaler, First try travis 2015-05-26 10:42:21 +02:00

README.md

Quantum package

Build Status

Gitter

Set of quantum chemistry programs and libraries.

For more information, you can visit the wiki of the project, or the Install file.