calculate Hamiltonian eigenvalue in siesta-4.1-b2
Asked by
zhikai
Dear siesta developers and users
I am trying to calculate MPSH eigenvalues by tbtrans. To calculate it, I add a fdf flag in the input file, such as:
TS.TBT.CalcIeig T
However, there is no xxxx.IEIG file generated. The version of siesta/
Any help will be appreciated!
Zhikai
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- Solved
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- Siesta Edit question
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- Solved by:
- Nick Papior
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