LU failed in BW-MRCC for 4 roots and 4 references

Click here for full thread

Forum Vet

6:53:48 AM PDT - Fri, Oct 23rd 2015
When NWchem6.6 is used, the same error appears at the 45th step; and I also add an a" into the targetsym, whether which I don't know is the cause of the difference from the NWchem6.5 result.