[molpro-user] error writing in CCSD

ERSIN YURTSEVER eyurtsev at ku.edu.tr
Mon Jul 13 07:54:10 BST 2009


Hi

I am running Molpro 2008.1. Trying a lccsd(t) on triphenylene. Basis definition is:

basis=avdz
df-hf,df_basis=vdz
df-lccsd(t),df_basis=vdz

During lccsd(t) step I get the error message:

Fitting-basis CC-PVDZ-MP2FIT loaded for 4-external integrals.
Number of fitting functions 1176

ERROR WRITING

Is this an error of not having enough disk space?
Can anybody suggest a solution?

thanks

ersin




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