Dear Andrei Postnikov, Thank you very much. I want to know why the two figures are so different (I expected them almost be superposition) after shift the fermi level. Even 1e is added to O2 molecule, it is not reasonable that the 2p orbitals of O2, O2- is so different. How does siesta find the systems fermi level
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- Re: [SIESTA-L] Shift Fermi-level Fen Hong
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- Re: [SIESTA-L] Shift Fermi-level apostnik
- [SIESTA-L] Target Temperature? Li, Shunfang
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- Re: [SIESTA-L] Shift Fermi-level Fen Hong
- Re: [SIESTA-L] Shift Fermi-level apostnik
- Re: [SIESTA-L] Shift Fermi-level Fen Hong
