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mirror of https://github.com/LCPQ/quantum_package synced 2024-11-05 21:54:02 +01:00
Commit Graph

2899 Commits

Author SHA1 Message Date
Thomas Applencourt
81ca7f2545 Remove ASSUMPTIONS.rst. Put it direcly in README.rst 2015-06-04 11:17:01 +02:00
Thomas Applencourt
42dde7faca Be agile, remove not usefull script 2015-06-04 11:10:32 +02:00
Thomas Applencourt
8416742bb0 Fix log always print 2015-06-04 10:57:50 +02:00
Thomas Applencourt
62595e5f25 Remove NEEDCHILDREN,inlcude and lib dir And move unit_test 2015-06-04 10:53:43 +02:00
Thomas Applencourt
a602ffd86b Modify ref value to good one 2015-06-03 18:55:29 +02:00
Thomas Applencourt
6465b8e9fd Set_ezfio_module_energy for DDCI and CAS_SD and and a COMPILE_RUN.md tutorial 2015-06-03 18:33:35 +02:00
Thomas Applencourt
be114d1d88 BYE BYE MAKEFILE ninja ! 2015-06-03 17:52:41 +02:00
Thomas Applencourt
0a6cc6b99f Modify travis.yml 2015-06-03 16:38:56 +02:00
Thomas Applencourt
c63cbab3ee Fix include 2015-06-03 15:32:43 +02:00
Thomas Applencourt
e99034d3f9 Try to merge... 2015-06-03 14:03:11 +02:00
Thomas Applencourt
515020863c Add missing tree 2015-06-03 13:52:38 +02:00
Thomas Applencourt
985592ad89 Fix ocaml makefile 2015-06-03 13:23:10 +02:00
Thomas Applencourt
1ef8ff12fd Corrent create_executables_list.sh path 2015-06-03 12:03:12 +02:00
Thomas Applencourt
7a0dd7a399 Solve bug in gfortran. Need to add -I . But now we have warning... 2015-06-03 11:32:10 +02:00
Thomas Applencourt
5812341787 Add ninja suport in gfortran config file 2015-06-03 10:51:32 +02:00
Thomas Applencourt
9b59b8afc2 Fix bug in replacent 'file' => 'f' 2015-06-03 10:19:02 +02:00
Thomas Applencourt
4f1335ee86 Add irpf90 flag to gfortran.cfg 2015-06-03 09:49:49 +02:00
Thomas Applencourt
c777891ef5 Pep8 2015-06-02 18:40:24 +02:00
Thomas Applencourt
8bf723dcfc Mega cleaning. 2015-06-02 18:17:59 +02:00
Anthony Scemama
379d552f53 Merge pull request #66 from scemama/master
Updated Pseudopotential and IRPF90/Ninja build
2015-06-02 17:34:38 +02:00
Thomas Applencourt
7396f2985f Modify some file 2015-06-02 15:47:24 +02:00
Thomas Applencourt
86af9c84fe Modify ifort_exemle.cfg 2015-06-02 15:46:24 +02:00
Thomas Applencourt
d3ce9c882a Cleaning create_ninja 2015-06-02 15:46:01 +02:00
Thomas Applencourt
cc9d710066 Add option to module_handler for print the header module 2015-06-01 19:32:02 +02:00
e66e38e12a Set precision to 5.e-7 in Travis 2015-05-28 14:05:13 +02:00
e7c1d713e8 Added install_ninja.sh 2015-05-28 13:25:16 +02:00
e4942942eb Repaired Travis 2015-05-28 13:18:34 +02:00
Thomas Applencourt
5f0883c05c Fix cache_compile.py and ninja make all the binary 2015-05-28 12:03:14 +02:00
0267780a19 Compiles with IRPF90/ninja 2015-05-28 01:22:02 +02:00
Thomas Applencourt
a48f089990 Better config_gfortran 2015-05-27 17:50:51 +02:00
Thomas Applencourt
ba49beff36 Remove makefile.depend dependancy ! 2015-05-27 11:02:13 +02:00
80210ba8cc Repaired travis 2015-05-27 00:55:29 +02:00
23a8215da3 Updated pseudo_grid 2015-05-26 23:35:35 +02:00
1e12737e0e Changed pseudo_ao in EZFIO 2015-05-26 21:37:17 +02:00
Thomas Applencourt
af1acde61f Add Update_readme to ninja 2015-05-26 17:43:43 +02:00
Thomas Applencourt
229053d011 Try to fix travis again... 2015-05-26 17:24:07 +02:00
Thomas Applencourt
f6b8964719 Compile all 2015-05-26 16:37:14 +02:00
Thomas Applencourt
dff2d2f8fa Fix for travis (add Read_compilation) 2015-05-26 16:09:09 +02:00
Thomas Applencourt
4acab896be Remove phony for l_irp 2015-05-26 13:35:34 +02:00
Thomas Applencourt
1cce664e5f Remove check_call for python 2.6 suport... 2015-05-26 11:39:39 +02:00
Thomas Applencourt
9746c6df28 Add ninja instaler, First try travis 2015-05-26 10:42:21 +02:00
Thomas Applencourt
7f6a006881 Fix issue when needed module is empty and beter rule for ocaml 2015-05-26 10:13:27 +02:00
Thomas Applencourt
47b8ca4873 Ninja work now /tmp/ninja/ninja -v -d explain build_all_binary! 2015-05-25 18:40:20 +02:00
Thomas Applencourt
e8a3b20cd5 Merge pull request #65 from scemama/master
Cleaning and Davidson in MRCC
2015-05-21 13:54:58 +02:00
Thomas Applencourt
091708c16b Cleanging cache_compile.py 2015-05-21 13:38:46 +02:00
2138113a95 Updated unit tests for travis 2015-05-21 13:22:29 +02:00
54a1487abb Travis didn't compile 2015-05-21 11:41:10 +02:00
Thomas Applencourt
c392599f84 Still working on ninja 2015-05-21 11:30:15 +02:00
23e3f5c5e8 Forgot file 2015-05-21 10:58:55 +02:00
e50e967018 Added Davidson in MRCC 2015-05-21 10:15:13 +02:00