SHELX C/D/E: Difference between revisions

No change in size ,  8 August 2009
Line 104: Line 104:
  FIND 8
  FIND 8
  DSCA 0.97
  DSCA 0.97
  NTRY 100
  NTRY 1000
  EOF
  EOF
  shelxd jia_fa
  shelxd jia_fa
  shelxe jia jia_fa -h -s0.6 -m20 -b
  shelxe jia jia_fa -h -s0.6 -m20 -b
  shelxe jia jia_fa -h -s0.6 -m20 -b -i
  shelxe jia jia_fa -h -s0.6 -m20 -b -i


The critical point for RIP is that you have to try many different DSCA values in the range 0.9 to 1.05.
The critical point for RIP is that you have to try many different DSCA values in the range 0.9 to 1.05.
1,330

edits