problem on Sm potential
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problem on Sm potential
Dear my friends
Recently, I am working on SmCo5 system. And a strange thing happened when using Sm paw PBE potential. The warning is:
"WARNING: CNORMN: search vector ill defined"
In fact, the problem also happens in other systems with Sm. But, when using Sm_3 (treat as 3+), everything will be perfect. However, we know it is not right for some systems.
Could one give me some advices or suggestions? Thanks so much in advance!
Thanks
Wen
Recently, I am working on SmCo5 system. And a strange thing happened when using Sm paw PBE potential. The warning is:
"WARNING: CNORMN: search vector ill defined"
In fact, the problem also happens in other systems with Sm. But, when using Sm_3 (treat as 3+), everything will be perfect. However, we know it is not right for some systems.
Could one give me some advices or suggestions? Thanks so much in advance!
Thanks
Wen
Last edited by wen on Tue Jan 21, 2014 3:27 am, edited 1 time in total.
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- Global Moderator
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Re: problem on Sm potential
Hi,
We're sorry that we didn’t answer your question. This does not live up to the quality of support that we aim to provide. The team has since expanded. If we can still help with your problem, please ask again in a new post, linking to this one, and we will answer as quickly as possible.
Best wishes,
VASP