[molpro-user] Problem insufficient memory available

Kirk Peterson kipeters at wsu.edu
Mon May 18 19:42:00 BST 2015


Andy,

the memory directive is global and does not belong in a program block as you have it below.  It should be at the very top of your
input file.  Even so, what you have specified, 4 megaword,s is quite small.  I would recommend starting with
a value of at least 50.

best regards,

-Kirk

> On May 18, 2015, at 9:49 AM, 林鴻安 <h7911200 at gmail.com> wrote:
> 
> Dear Molpro-users,
> 
> Whether this problem can be solved?
> I tried many way to slove it.but the problem still exists.
> 
> that it my input:
> GEOMETRY = {ang; O1; O2,O1,R}
>  GPRINT
>  BASIS = AVQZ
>  R = 1.4
>  closed,2,0,0,0,2,0,0
>  occ,5,2,2,0,4,1,1,0
>  do i = 1,8
>     wf,16,i,2
>     multi;ORBITAL,IGNORE_ERROR;state,6
>     mrci;ORBITAL,IGNORE_ERROR;state,6;MEMORY,4,M
> 
>  enddo
> 
> problem: 
> insufficient memory available - require                3713294  have
>                2331704
>  the request was for real words
> 
> Thank you for your help.
> 
> 
> Best regards
> 
> Andy
> 
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