mirror of
https://github.com/pfloos/quack
synced 2025-03-09 18:22:25 +01:00
Added one space, it is doing MOM
This commit is contained in:
parent
f688dd6cec
commit
f7b8a7ce4e
@ -215,6 +215,7 @@ subroutine HFB(dotest,maxSCF,thresh,max_diis,level_shift,nNuc,ZNuc,rNuc,ENuc, &
|
||||
c_hfb = matmul(X_hfb,cp)
|
||||
|
||||
! Compute MOM and reshufle the states
|
||||
|
||||
mom=matmul(cOld_T,matmul(S_hfb,c_hfb))
|
||||
do iorb=1,nOrb2
|
||||
project(iorb)=sqrt(dot_product(mom(:,iorb),mom(:,iorb)))
|
||||
|
Loading…
x
Reference in New Issue
Block a user