Example: OH- noSCC¶

#!/bin/sh

$AMSBIN/ams << eor

Task SinglePoint

Properties
   Gradients True
End

System
    Atoms
        H         0.000000     0.000000  0.000000
        O         0.98         0.000000  0.000000
    End
    Charge -1
End

Engine DFTB
   ResourcesDir Dresden
   Model DFTB0
   DispersionCorrection Auto
EndEngine

eor