Anthony Scemama acde03a045 Works again for H		2017-11-09 14:57:51 +01:00
..
AO	New IRPF90	2017-06-14 01:11:26 +02:00
JASTROW	ZMQ versio update	2017-03-26 21:36:23 +02:00
MAIN	Added scripts	2015-12-20 01:09:14 +01:00
PROPERTIES	Removed useless property	2016-12-29 01:48:59 +01:00
SAMPLING	Fixed duration of a block	2017-10-12 15:51:15 +02:00
TOOLS	Merge branch 'master' of github.com:scemama/qmcchem	2017-10-09 19:59:13 +02:00
ZMQ	Less walkers traffic	2016-04-05 00:48:37 +02:00
.gitignore	Works with gfortran. Fixed ezfio.ml compiling problem.	2015-12-29 00:48:17 +01:00
constants.F	Added some .irp.f files	2015-12-19 03:29:52 +01:00
det.irp.f	Works again for H	2017-11-09 14:57:51 +01:00
electrons.irp.f	Removed padding in sparse_full_mv	2016-06-03 14:14:27 +02:00
ezfio_interface.irp.f	Merge branch 'develop' into feature/zveloc	2016-06-24 09:14:33 +02:00
finish.irp.f	Added some .irp.f files	2015-12-19 03:29:52 +01:00
mo_point.irp.f	Added some .irp.f files	2015-12-19 03:29:52 +01:00
mo.irp.f	Commented prefetch instructions	2016-11-28 15:08:55 +01:00
nuclei.irp.f	Changed norm of MOs when the fitcusp is used	2016-03-17 15:41:47 +01:00
point.irp.f	Added some .irp.f files	2015-12-19 03:29:52 +01:00
prepare_walkers.irp.f	Better prepare_walkers	2016-03-29 15:20:03 +02:00
properties.py	Added some .irp.f files	2015-12-19 03:29:52 +01:00
pseudo.irp.f	Added D and F spherical harmonics in pseudo	2016-07-21 16:06:40 +02:00
psi.irp.f	Removed ao_value and psi_grad_x	2016-01-11 22:52:47 +01:00
simulation.irp.f	Fixed duration of a block	2017-10-12 15:51:15 +02:00
types.F	ZV energy	2016-05-02 21:19:36 +02:00
wf.irp.f	DGEMV for dense matrices	2017-10-09 21:39:00 +02:00