Dear Artem,

This doesn't look correct. I guess it is some problems with the .TSHS files
or sizes of basis set maybe. Can you send the full input/output, please.

2013/8/3 Artem Baskin <[email protected]>

> Device atoms 11-14, orbitals 151-190
> Left self energy on orbitals 151-175
> Right self energy on orbitals 151-190
>

Regards
Henrik

Responder a