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quantum_package/scripts/ezfio_interface
Thomas Applencourt 3c6942c690 Add new IO point for better restarting (#86)
* Add new IO point for beter restarting

* Fix configure for bats

* Fix missing file. Standardize the way to construct hamiltonien

* Do not provide *_pseudo_integral if not needed. Remove false dependency in the dataflow graph

* Add automatic generation of provider for disk_acess

* Fix naming of provider from Disk_acess

* Fix diskacess generation

* Remove spurious files

* Change logic in naming

* Add more layer of io for ao_one_e_integrals

* Add IO layer for MO one e fix AO one

* Why not...

* Update configure
2019-01-04 22:57:29 +01:00
..
ei_handler.py Add new IO point for better restarting (#86) 2019-01-04 22:57:29 +01:00
ezfio_generate_ocaml.py python2 2018-04-30 18:43:32 +02:00
ezfio_generate_provider.py Add new IO point for better restarting (#86) 2019-01-04 22:57:29 +01:00
qp_convert_output_to_ezfio Nocurl (#75) 2018-11-20 11:33:07 +01:00
qp_edit_template Check memory 2018-12-13 16:54:28 +01:00