Trying to run a large casscf in multi I get the folloeing error. If anyone has seen this before and can give me advic it would be appreciated.
ITER. MIC NCI NEG ENERGY(VAR) ENERGY(PROJ) ENERGY CHANGE GRAD(0) GRAD(ORB) GRAD(CI) STEP TIME ERROR WRITING 56072066 WORDS AT OFFSET 224731053. TO FILE 1 IMPLEMENTATION=df FILE HANDLE= 7 IERR=****** ? Error ? I/O error ? The problem occurs in writew ERROR EXIT CURRENT STACK: MAIN Write error in iow_direct_write; fd=7, l=56072066, p=224731053; read returns 349635223 Thanks John John Steven Sears Center for Computational Molecular Science and Technology School of Chemistry and Biochemistry Georgia Institute of Technology Atlanta, GA 30332-0400 Office: Boggs 3-19 Phone: 404-385-1310 Email: [EMAIL PROTECTED]
