LCPQ/qp2
9
1
Fork 0
mirror of https://github.com/QuantumPackage/qp2.git synced 2024-11-18 11:23:38 +01:00
Code Releases Activity

Merge branch 'master' into dev

Browse Source
This commit is contained in:
Anthony Scemama 2021-06-07 16:03:21 +02:00
commit 220b2fad30
1 changed files with 2 additions and 2 deletions
Show Stats Download Patch File Download Diff File Expand all files Collapse all files

4
src/davidson/diagonalize_ci.irp.f
View File

@ -57,8 +57,8 @@ END_PROVIDER
enddo enddo
! Deactivated temporarily: bug in N_csf ! Deactivated temporarily: bug in N_csf
do_csf = s2_eig .and. only_expected_s2 .and. (expected_s2 == 0.d0) ! do_csf = s2_eig .and. only_expected_s2 .and. (expected_s2 == 0.d0)
! do_csf = .False. do_csf = .False.
if (diag_algorithm == "Davidson") then if (diag_algorithm == "Davidson") then