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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-07-13 14:34:30 +02:00

removed useless arrays for two_rdm

This commit is contained in:
Emmanuel Giner 2021-01-07 14:24:44 +01:00
parent 970f846a4d
commit 7874e4f037

View File

@ -1,45 +1,21 @@
[two_rdm_ab_disk]
type: double precision
doc: active part of the two body rdm alpha/beta stored on disk
interface: ezfio
size: (bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,determinants.n_states)
[io_two_body_rdm_ab]
type: Disk_access
doc: Read/Write the active part of the two-body rdm for alpha/beta electrons from/to disk [ Write | Read | None ]
interface: ezfio,provider,ocaml
default: None
[two_rdm_aa_disk]
type: double precision
doc: active part of the two body rdm alpha/alpha stored on disk
interface: ezfio
size: (bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,determinants.n_states)
[io_two_body_rdm_aa]
type: Disk_access
doc: Read/Write the active part of the two-body rdm for alpha/alpha electrons from/to disk [ Write | Read | None ]
interface: ezfio,provider,ocaml
default: None
[two_rdm_bb_disk]
type: double precision
doc: active part of the two body rdm beta/beta stored on disk
interface: ezfio
size: (bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,determinants.n_states)
[io_two_body_rdm_bb]
type: Disk_access
doc: Read/Write the active part of the two-body rdm for beta/beta electrons from/to disk [ Write | Read | None ]
interface: ezfio,provider,ocaml
default: None
[two_rdm_spin_trace_disk]
type: double precision
doc: active part of the two body rdm spin trace stored on disk
interface: ezfio
size: (bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,bitmask.n_act_orb,determinants.n_states)
[io_two_body_rdm_spin_trace]
type: Disk_access
doc: Read/Write the active part of the two-body rdm for spin trace electrons from/to disk [ Write | Read | None ]