CCL:G: ESP-derived-charge error messages
- From: "Siamkhanthang Neihsial"
<sktn06|*|gmail.com>
- Subject: CCL:G: ESP-derived-charge error messages
- Date: Fri, 1 Aug 2008 09:23:11 -0400
Sent to CCL by: "Siamkhanthang Neihsial" [sktn06*gmail.com]
Dear all,
I was trying to run an ESP-derived charge calculation in Gaussian 03 for my
sytem at single point calculation at MP2/6-311++G(d,p) pop=mk iop(6/33=2)
iop(6/42=6)level on the optimized geometry calculated at the level of
B3LYP/6-31g(d,p). My system is a novel base-pair consisting of 85 atoms,
including six N atoms, four P atoms,twenty three O atoms. The sugar is a
D-allopyranose .I got the following error messages--, " Erroneous write:
write -1 instead of 4096, fd=4, orig len=4096 left=4096, g-write, "
Can any one tell me the significance of this messages and how to solve it ? .
Ofcourse, when I used B3LYP/6-311++G(d,p) the job terminated normally.
Thanks in advance,
Siamkhanthang Neihsial,
Deptt. of Chemistry,
NEHU, Shillong(India)
sktn06##gmail.com