LCPQ/quantum_package
10
0
Fork 0
mirror of https://github.com/LCPQ/quantum_package synced 2024-11-04 21:24:02 +01:00
Code Issues Releases Wiki Activity

Fixed state_average_weight.gz different from array

Browse Source
This commit is contained in:
Anthony Scemama 2018-02-15 12:00:45 +01:00
parent ee53802402
commit ab0eb1256b
2 changed files with 21 additions and 11 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

2
configure vendored
View File

@ -497,7 +497,7 @@ def create_ninja_and_rc(l_installed):
'export LIBRARY_PATH=$(qp_prepend_export "LIBRARY_PATH" "${QP_ROOT}"/lib:"${QP_ROOT}"/lib64)', 'export LIBRARY_PATH=$(qp_prepend_export "LIBRARY_PATH" "${QP_ROOT}"/lib:"${QP_ROOT}"/lib64)',
'export C_INCLUDE_PATH=$(qp_prepend_export "C_INCLUDE_PATH" "${QP_ROOT}"/include)', 'export C_INCLUDE_PATH=$(qp_prepend_export "C_INCLUDE_PATH" "${QP_ROOT}"/include)',
'', '',
'if [[ $SHELL == "bash" ]] ; then', 'if [[ $SHELL == "/bin/bash" ]] ; then',
' source ${QP_ROOT}/install/EZFIO/Bash/ezfio.sh', ' source ${QP_ROOT}/install/EZFIO/Bash/ezfio.sh',
'fi', 'fi',
'', '',

30
ocaml/Input_determinants_by_hand.ml
View File

@ -119,21 +119,31 @@ end = struct
;; ;;
let read_state_average_weight () = let read_state_average_weight () =
let n_states =
read_n_states ()
|> States_number.to_int
in
if not (Ezfio.has_determinants_state_average_weight ()) then if not (Ezfio.has_determinants_state_average_weight ()) then
begin begin
let n_states =
read_n_states ()
|> States_number.to_int
in
let data = let data =
Array.init n_states (fun _ -> 1./.(float_of_int n_states)) Array.init n_states (fun _ -> 1./.(float_of_int n_states))
|> Array.map ~f:Positive_float.of_float |> Array.map ~f:Positive_float.of_float
in in
write_state_average_weight data; write_state_average_weight data
end; end;
Ezfio.get_determinants_state_average_weight () let result =
|> Ezfio.flattened_ezfio Ezfio.get_determinants_state_average_weight ()
|> Array.map ~f:Positive_float.of_float |> Ezfio.flattened_ezfio
|> Array.map ~f:Positive_float.of_float
in
if Array.length result = n_states then
result
else
let data =
Array.init n_states (fun _ -> 1./.(float_of_int n_states))
|> Array.map ~f:Positive_float.of_float
in
(write_state_average_weight data; data)
;; ;;
let read_expected_s2 () = let read_expected_s2 () =