debug part 6
authorAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Mon, 25 May 2015 10:43:12 +0000 (12:43 +0200)
committerAdam Sieradzan <adasko@piasek4.chem.univ.gda.pl>
Mon, 25 May 2015 10:43:12 +0000 (12:43 +0200)
source/wham/src-M/energy_p_new.F

index bedf32e..264cdfc 100644 (file)
@@ -929,6 +929,7 @@ C Calculate the radial part of the gradient
 C Calculate angular part of the gradient.
             call sc_grad
             endif
+            write(iout,*)  "partial sum", evdw, evdw_t
             ENDIF    ! dyn_ss            
           enddo      ! j
         enddo        ! iint