mirror of
https://github.com/pfloos/quack
synced 2024-08-27 22:51:50 +02:00
CCD
This commit is contained in:
parent
51920c0ada
commit
5f015026e4
@ -260,7 +260,7 @@ program MCQC
|
|||||||
if(doCC) then
|
if(doCC) then
|
||||||
|
|
||||||
call cpu_time(start_CC)
|
call cpu_time(start_CC)
|
||||||
call CC(nBas,nEl,ERI_MO_basis,ENuc,ERHF,eHF,cHF)
|
call CCD(nBas,nEl,ERI_MO_basis,ENuc,ERHF,eHF,cHF)
|
||||||
call cpu_time(end_CC)
|
call cpu_time(end_CC)
|
||||||
|
|
||||||
t_CC = end_CC - start_CC
|
t_CC = end_CC - start_CC
|
||||||
|
Loading…
Reference in New Issue
Block a user