scemama/qp_plugins_scemama
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6f04cc0eb0
qp_plugins_scemama/devel/trexio
History
Anthony Scemama 6f04cc0eb0 Allow no basis set
2023-05-10 14:44:30 +02:00
..
export_trexio_routines.irp.f Fixed one-two electron 2023-05-04 17:49:41 +02:00
export_trexio.irp.f Added export_trexio routine 2023-03-09 10:50:44 +01:00
EZFIO.cfg Added cholesky vectors in export 2023-05-04 14:31:49 +02:00
import_trexio_determinants.irp.f Import WF from TREXIO 2022-04-27 16:06:56 +02:00
import_trexio_integrals.irp.f Allow no basis set 2023-05-10 14:44:30 +02:00
install Fixed dimensions in cholesky 2023-05-04 16:37:00 +02:00
NEED Removed trexio_f.f90 2022-11-30 17:34:32 +01:00
qp_import_trexio.py Allow no basis set 2023-05-10 14:44:30 +02:00
README.rst Start writing trexio file 2021-05-05 17:15:14 +02:00
trexio_file.irp.f Forgot file 2021-06-27 15:53:27 +02:00
trexio_module.F90 Removed trexio_f.f90 2022-11-30 17:34:32 +01:00
uninstall Fix trexio->QP converter 2022-12-05 17:47:27 +01:00

README.rst 

======
trexio
======