Problem running a nanostructure
Posted: Mon Nov 20, 2006 8:16 am
I've received a warning message as below when running single point calculation for my structure. However there is no error message and the calculations stopped just after finding the number of irreducible k points.
Is this error due to the structure or other factors that is not stated in the outcar? I'm trying to run a nano-structure here and this explains the small distance.
What should I do to remedy or find out the cause of the problem? Thanks.
The distance between some ions is very small |
| please check the nearest neigbor list in the OUTCAR file |
| I HOPE YOU KNOW, WHAT YOU ARE DOING
Is this error due to the structure or other factors that is not stated in the outcar? I'm trying to run a nano-structure here and this explains the small distance.
What should I do to remedy or find out the cause of the problem? Thanks.
The distance between some ions is very small |
| please check the nearest neigbor list in the OUTCAR file |
| I HOPE YOU KNOW, WHAT YOU ARE DOING