Name
DELSC — Specify the effective molecular radius of the desired solvent.
Description
DELSC is the radial distance in Angstroms between the surface accessible to the centers
of solvent molecules and the surface accessible to solvent charges. By default, DELSC is the
same as RSOLV but it may be explicitly set to n.n using this keyword. The allowed values are
0.1 Å ≤ DELSC ≤ RSOLV + 0.5 Å but the
recommended range is 0.5 Å ≤ DELSC ≤ RSOLV.
See Chapter 14, COSMO Solvation Model for more details.
Default value:
Use value from RSOLV
