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This commit is contained in:
Anthony Scemama 2016-12-29 22:11:11 +01:00
parent bbe9024304
commit 0ef200d6b1
3 changed files with 46 additions and 0 deletions
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33
plugins/mrcc_selected/EZFIO.cfg Normal file
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[lambda_type]
type: Positive_int
doc: lambda type
interface: ezfio,provider,ocaml
default: 0
[energy]
type: double precision
doc: Calculated energy
interface: ezfio
[energy_pt2]
type: double precision
doc: Calculated energy with PT2 contribution
interface: ezfio
[energy]
type: double precision
doc: Calculated energy
interface: ezfio
[thresh_dressed_ci]
type: Threshold
doc: Threshold on the convergence of the dressed CI energy
interface: ezfio,provider,ocaml
default: 1.e-5
[n_it_max_dressed_ci]
type: Strictly_positive_int
doc: Maximum number of dressed CI iterations
interface: ezfio,provider,ocaml
default: 10

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plugins/mrcc_selected/NEEDED_CHILDREN_MODULES Normal file
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Perturbation Selectors_full Generators_full Psiref_threshold MRCC_Utils ZMQ

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plugins/mrcc_selected/README.rst Normal file
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=======
mrcepa0
=======
Needed Modules
==============
.. Do not edit this section It was auto-generated
.. by the `update_README.py` script.
Documentation
=============
.. Do not edit this section It was auto-generated
.. by the `update_README.py` script.