In performing minimization I got stars in the .sandout (EEL value) and
in the .restrt although the system reaches the convergence. It happens
with ISFTRP=1, if =0 no problems. Here is the input file:
#cdk2-parametri mg
#
&cntrl
imin=1,nmrmax=0,
ntx=1,irest=0,
ntpr=50,ntwx=50,ntwv=0,ntwe=50,ntwxm=0,
ntf=1,idiel=1,dielc=1.0,cut=10.0,
nsnb=25,scnb=2.0,scee=1.2,
isftrp=1,
cut2nd=15.0,
ibelly=1,
maxcyc=10000,ncyc=2000,ntmin=1,
dx0=0.01,dxm=0.5,drms=0.15,
&end
residui che si muovono
RES 302 3323
END
END
Where is the problem ?
Cristina Dezi
Received on Fri May 26 2000 - 01:15:01 PDT
