--- trunk/OOPSE/libmdtools/calc_LJ_FF.F90 2004/01/06 18:54:57 900 +++ trunk/OOPSE/libmdtools/calc_LJ_FF.F90 2004/02/09 14:48:57 1041 @@ -2,7 +2,7 @@ !! Corresponds to the force field defined in lj_FF.cpp !! @author Charles F. Vardeman II !! @author Matthew Meineke -!! @version $Id: calc_LJ_FF.F90,v 1.15 2004-01-06 18:54:57 chuckv Exp $, $Date: 2004-01-06 18:54:57 $, $Name: not supported by cvs2svn $, $Revision: 1.15 $ +!! @version $Id: calc_LJ_FF.F90,v 1.17 2004-02-09 14:48:57 chrisfen Exp $, $Date: 2004-02-09 14:48:57 $, $Name: not supported by cvs2svn $, $Revision: 1.17 $ module lj use definitions @@ -93,6 +93,8 @@ contains status = 0 LJ_rcut = rcut +!!$ ! ATTENTION! This is a hardwiring of rcut! +!!$ LJ_rcut = 9.0d0 haveCut = .true. if (havePolicy) then @@ -209,7 +211,6 @@ contains real( kind = dp ) :: delta integer :: id1, id2 - if (rij.lt.LJ_rcut) then ! Look up the correct parameters in the mixing matrix