Anthony Scemama 5e8de3e583 Merge /home/scemama/qmcchem_mu		2021-07-30 18:18:37 +02:00
..
AO	New IRPF90	2017-06-14 01:11:26 +02:00
JASTROW	Added Jastrow mu (giner)	2021-07-30 18:15:13 +02:00
MAIN	WIP Transcorrelated	2021-07-30 18:18:18 +02:00
PROPERTIES	Merge /home/scemama/qmcchem_mu	2021-07-30 18:18:37 +02:00
SAMPLING	Fixed exploding energies with pseudos	2020-05-11 13:49:07 +02:00
TOOLS	More precise Ylm	2020-05-24 03:02:00 +02:00
ZMQ	Jastrow optimization script	2020-05-04 12:13:06 +02:00
.gitignore	Fixed Makefiles	2019-10-01 09:36:29 +02:00
constants.F	Added some .irp.f files	2015-12-19 03:29:52 +01:00
det.irp.f	Fast SVD	2021-06-21 14:30:29 +02:00
electrons.irp.f	Removed padding in sparse_full_mv	2016-06-03 14:14:27 +02:00
ezfio_interface.irp.f	Added Jastrow mu (giner)	2021-07-30 18:15:13 +02:00
finish.irp.f	Added some .irp.f files	2015-12-19 03:29:52 +01:00
Makefile	Fixed Makefiles	2019-10-01 09:36:29 +02:00
mo_point.irp.f	Added some .irp.f files	2015-12-19 03:29:52 +01:00
mo.irp.f	DIR -> OMP	2021-05-31 14:01:33 +02:00
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	Updates	2019-07-01 11:32:01 +02:00
pseudo.irp.f	More precise Ylm	2020-05-24 03:02:00 +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
svd.irp.f	keep svd coefs	2021-06-29 15:56:10 +02:00
types.F	ZV energy	2016-05-02 21:19:36 +02:00
wf.irp.f	Fast SVD	2021-06-21 14:30:29 +02:00