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Update EZFIO.cfg

There were wrong types and typos
This commit is contained in:
madgal 2017-06-13 11:45:48 -05:00 committed by GitHub
parent 7a6c29cb70
commit 72ea8a80bd

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@ -7,22 +7,22 @@ type: integer
interface: ezfio
doc: number of determinants at iteration
type: integer
size: (fci_iterations.n_iter)
size: (FCI_Iteration.n_iter)
[energy]
interface: ezfio
doc: The energy without a pt2 correction for n_det
type: real
size: (fci_iterations.n_iter)
type: double precision
size: (FCI_Iteration.n_iter)
[pt2]
interface: ezfio
doc: The pt2 correction for n_det
type: real
size: (fci_iterations.n_iter)
type: double precision
size: (FCI_Iteration.n_iter)
[energy_pt2]
interface: ezfio
doc: The energy with pt2 correction for n_det
type: real
size: (fci_iterations.n_iter)
type: double precision
size: (FCI_Iteration.n_iter)