9
1
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-07-19 17:23:25 +02:00

Moved seniority in CIPSI

This commit is contained in:
Anthony Scemama 2020-12-10 17:54:50 +01:00
parent e25c8abb0f
commit a854d5a4c5
2 changed files with 6 additions and 5 deletions

View File

@ -3,3 +3,9 @@ type: logical
doc: If true, computes the one- and two-body rdms with perturbation theory
interface: ezfio,provider,ocaml
default: False
[seniority]
type: integer
doc: Using -1 selects all determinants
interface: ezfio,ocaml,provider
default: -1

View File

@ -10,8 +10,3 @@ doc: Calculated |FCI| energy + |PT2|
interface: ezfio
size: (determinants.n_states)
[seniority]
type: integer
doc: Using -1 selects all determinants
interface: ezfio,ocaml,provider
default: -1