I am tyng to run a input file in adf-1999.
It is a normal single point calculation, but UNRESTRICTED and I also
want a ESR calculation.
The logfile gives me the follow message:
(LOGFILE)
 <Oct11-1999> <16:12:30> ADF 1999.02 RunTime: Oct11-1999 16:12:30
 <Oct11-1999> <16:12:30> Mo(etawho knows-IND)Cp(P(OH)3)2 + sem
simetria sp esr
 <Oct11-1999> <16:12:30> RunType : SINGLE POINT
 <Oct11-1999> <16:12:31> Net Charge: 1 (Nuclei minus Electrons)
 <Oct11-1999> <16:12:31> Spin polar: 1 (Spin_A minus Spin_B electrons)
 <Oct11-1999> <16:12:31> Symmetry : NOSYM
 <Oct11-1999> <16:12:32> >>>> FRAGM
 <Oct11-1999> <16:12:35> >>>> CORORT
 <Oct11-1999> <16:12:36> >>>> FITINT
 <Oct11-1999> <16:15:11> >>>> ORTHON
 <Oct11-1999> <16:15:17> >>>> CRTP12
 <Oct11-1999> <16:15:20> >>>> GENPT
 <Oct11-1999> <16:15:20> Acc.Num.Int.= 4.000
 <Oct11-1999> <16:15:34> Block Length= 64
 <Oct11-1999> <16:15:39> >>>> PTCOR
 <Oct11-1999> <16:15:45> >>>> PTBAS
 <Oct11-1999> <16:17:33> >>>> CYCLE
 <Oct11-1999> <16:20:46> 1
 <Oct11-1999> <16:20:51> kfwr_prepar: Enlarge variable Pmat_A
 <Oct11-1999> <16:20:51> WARNING: not all scratch files were closed
 <Oct11-1999> <16:20:51> END
ERROR DETECTED
Does anyone knows the meaning of this error?
Thanks
Angela

--
Angela Prazeres
ITQB Apartado 127
2781-901 OEIRAS PORTUGAL
Tel:351-1-4469769