[molpro-user] insufficient memory available
Huang, Wei
wei.huang at pnl.gov
Mon Jun 1 09:00:16 BST 2009
Hi,
I did a ccsd(T) calculation, when using "memory, 430, m", got
Number of core orbitals: 19 ( 19 )
Number of closed-shell orbitals: 28 ( 28 )
Number of active orbitals: 1 ( 1 )
Number of external orbitals: 541 ( 541 )
insufficient memory available - require 246144721 have
183229730
the request was for real words
when using "memory, 800, m", got
Number of core orbitals: 19 ( 19 )
Number of closed-shell orbitals: 28 ( 28 )
Number of active orbitals: 1 ( 1 )
Number of external orbitals: 541 ( 541 )
insufficient memory available - require 246144721 have
60940288
the request was for real words.
Looks there was no effect when the memory increased and the available
memory even became less.
Thanks,
Wei
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