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Documentation of EZFIO in Fortran #23

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scemama opened this issue Nov 28, 2014 · 0 comments
Closed

Documentation of EZFIO in Fortran #23

scemama opened this issue Nov 28, 2014 · 0 comments

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@scemama
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scemama commented Nov 28, 2014

A python script ezfio_interface.py will read a DEPENDENCY config file with ConfigParser of the form (for example)

[n_det]
doc:        Number of states to consider
ezfio_name: det_num
ezfio_type: integer
ezfio_dir:  determinants

and will create the *.ezfio_config file, and the ezfio_interface.irp.f file.

from ezfio_with_default import EZFIO_Provider can be used to generate ezfio_interface.irp.f.

@scemama scemama closed this as completed Apr 10, 2015
TApplencourt added a commit that referenced this issue Jul 2, 2015
scemama added a commit that referenced this issue Nov 13, 2015
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