[molpro-user] differences between 2006 and 2008

[ERSIN YURTSEVER]

I am running a df-lmp2 of formic acid with aug-cc-pVQZ basis and geometry optimization. Using memory,150m with Molpro 2006.1, I do not have any problems. However, with Molpro 2008.1 even with memory,300m or more, the optimization stops with insufficient memory message. I am attaching the input file and output of both versions. Any help is appreciated.

thanks

ersin 

-------------- next part --------------
A non-text attachment was scrubbed...
Name: input2008.doc
Type: application/msword
Size: 310 bytes
Desc: not available
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20091103/c69f77b7/attachment.doc>
-------------- next part --------------
A non-text attachment was scrubbed...
Name: outfiles.gz
Type: application/octet-stream
Size: 10557 bytes
Desc: not available
URL: <http://www.molpro.net/pipermail/molpro-user/attachments/20091103/c69f77b7/attachment.obj>