[molpro-user] Write Error
John S. Sears
gtg390f at mail.gatech.edu
Wed Jul 7 16:50:45 BST 2004
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: john.sears at chemistry.gatech.edu
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