9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-06-17 10:05:18 +02:00

Merge branch 'dev-stable' of https://github.com/QuantumPackage/qp2 into dev-stable
Some checks failed
continuous-integration/drone/push Build is failing

This commit is contained in:
eginer 2023-09-01 11:35:54 +02:00
commit 2ff59e6869

View File

@ -2,7 +2,7 @@
type: character*(32)
doc: Define the kind of hessian for the orbital optimization full : full hessian, diag : diagonal hessian, none : no hessian
interface: ezfio,provider,ocaml
default: full
default: diag
[n_det_max_opt]
type: integer
@ -14,7 +14,7 @@ default: 200000
type: integer
doc: Maximal number of iterations for the orbital optimization
interface: ezfio,provider,ocaml
default: 20
default: 10
[thresh_opt_max_elem_grad]
type: double precision