Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
moread error
Jonas Baltrusaitis
jonas-baltrusaitis@uiowa.edu
I am getting this annoying moread error
PREMATURE END OF ORBITAL INPUT ENCOUNTERED
LOOKING FOR ORBITAL 155 ELEMENT 1
It's bizarre since I simply took msscf PUNCH and plugged calculation setup part above VEC so everything should be there. I checked, all 724 orbitals are there. I did it exactly the same way after cisprop run as a guess and that worked fine, but mcscf guess for mcscf calculation can;t be read for some reason. So, it aborts, could anybody explain why?thanks
Jonas
| This message contains the 6627 kb attachment
[ moread_error.zip ] |
[ This message was edited on Sat Sep 24 '11 at 10:20pm by the author ]
Sat Sep 24 '11 10:20pm
This message read 1330 times