[molpro-user] Problem insufficient memory available

林鴻安 h7911200 at gmail.com
Mon May 18 17:49:15 BST 2015


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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