[molpro-user] FW: MOLPRO problem ---- Too many records
Hrusak Jan
hrusak at kav.cas.cz
Thu Jan 31 20:34:31 GMT 2013
Dear all,
when doing a relaxed MCSCF scan on a relatively small system I get after few successfully calculated geometry optimizations a message
More than 200 records on file 2
? Error
? Too many records
? The problem occurs in reservem
Is there a straight way around this problem? Is there a possibility to reset the internal counter of records and/or to overwrite those?
For some reasons I like to do the whole calculation of 1 row in one job.
Kindly thanks for help
Jan
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