In the present release of the DALTON program, there are certain limitations imposed on the optimizing geometries using the solvent model. Only second-order geometry optimizations are available, and only through the general *WALK module. Thus the input for an SCF geometry optimization with the solvent model would look like:
**DALTON INPUT .WALK **INTEGRALS *ONEINT .SOLVENT 10 **WAVE FUNCTIONS .HF *SOLVENT .DIELECTRIC CONSTANT 78.5 .MAX L 10 .CAVITY 3.98 **PROPERTIES .VIBANA .SHIELD **END OF DALTON INPUT