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AO
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New IRPF90
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2017-06-14 01:11:26 +02:00 |
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JASTROW
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Minor changes
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2020-08-26 10:41:53 +02:00 |
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MAIN
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Added scripts
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2015-12-20 01:09:14 +01:00 |
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PROPERTIES
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Minor changes
|
2020-08-26 10:41:53 +02:00 |
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SAMPLING
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Fixed exploding energies with pseudos
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2020-05-11 13:49:07 +02:00 |
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TOOLS
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More precise Ylm
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2020-05-24 03:02:00 +02:00 |
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ZMQ
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Jastrow optimization script
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2020-05-04 12:13:06 +02:00 |
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.gitignore
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Fixed Makefiles
|
2019-10-01 09:36:29 +02:00 |
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Makefile
|
Fixed Makefiles
|
2019-10-01 09:36:29 +02:00 |
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constants.F
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Added some .irp.f files
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2015-12-19 03:29:52 +01:00 |
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det.irp.f
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Updates
|
2019-07-01 11:32:01 +02:00 |
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electrons.irp.f
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Removed padding in sparse_full_mv
|
2016-06-03 14:14:27 +02:00 |
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ezfio_interface.irp.f
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Fixing Ocaml
|
2019-07-23 17:27:02 +02:00 |
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finish.irp.f
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Added some .irp.f files
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2015-12-19 03:29:52 +01:00 |
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mo.irp.f
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Fixing Ocaml
|
2019-07-23 17:27:02 +02:00 |
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mo_point.irp.f
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Added some .irp.f files
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2015-12-19 03:29:52 +01:00 |
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point.irp.f
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Added some .irp.f files
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2015-12-19 03:29:52 +01:00 |
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prepare_walkers.irp.f
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Better prepare_walkers
|
2016-03-29 15:20:03 +02:00 |
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properties.py
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Updates
|
2019-07-01 11:32:01 +02:00 |
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pseudo.irp.f
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More precise Ylm
|
2020-05-24 03:02:00 +02:00 |
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psi.irp.f
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Removed ao_value and psi_grad_x
|
2016-01-11 22:52:47 +01:00 |
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simulation.irp.f
|
Fixed duration of a block
|
2017-10-12 15:51:15 +02:00 |
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types.F
|
ZV energy
|
2016-05-02 21:19:36 +02:00 |
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wf.irp.f
|
Introduced psi_det_tmp
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2020-07-17 21:19:06 +02:00 |
Anthony Scemama
7e4c64a81b