Firefly and PC GAMESS-related discussion club
Learn how to ask questions correctly
SAMPLE IS NOT GETTING OPTIMIZED AT ALL...
Please find attached a sample file of Boron nanotube. I have failed for the nth time to get it optimized. I want its Hessian too. Please help me in finding out what is wrong with it. In addition I would say that it is really taking long to optimize it. Could you throw some light on how to make it faster?
| ||This message contains the 4 kb attachment|
[ BNNT23.inp ]
Mon Sep 9 '13 8:09am
This message read 1069 times