Bond Order Potential |
- Date: 2009/02/06 13:58
- Name: Igarashi
- Dear all,
I am new user of OpenMX. I want to estimate the bond order potential between atoms. However, I cannot find any keyword for BOP in the manual or this forum. Cound you please advice me how to estimate BOP using OpenMX ?
Thank you very much,
T. Igarashi
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