mirror of
https://github.com/QuantumPackage/qp2.git
synced 2024-12-22 20:34:58 +01:00
Merge branch 'dev-stable' of github.com:QuantumPackage/qp2 into dev-stable
This commit is contained in:
commit
ad02fa9694
@ -88,7 +88,7 @@ subroutine diag_htilde_mu_mat_fock_bi_ortho(Nint, det_in, hmono, htwoe, hthree,
|
|||||||
call a_tc_operator ( occ_hole (i,ispin), ispin, det_tmp, hmono,htwoe,hthree, Nint,na,nb)
|
call a_tc_operator ( occ_hole (i,ispin), ispin, det_tmp, hmono,htwoe,hthree, Nint,na,nb)
|
||||||
enddo
|
enddo
|
||||||
enddo
|
enddo
|
||||||
htot = hmono+htwoe+hthree
|
htot = hmono+htwoe+hthree+nuclear_repulsion
|
||||||
end
|
end
|
||||||
|
|
||||||
subroutine ac_tc_operator(iorb,ispin,key,hmono,htwoe,hthree,Nint,na,nb)
|
subroutine ac_tc_operator(iorb,ispin,key,hmono,htwoe,hthree,Nint,na,nb)
|
||||||
|
Loading…
Reference in New Issue
Block a user