Element-specific scaling of vdW radii

[marcelmbn]

• relevant for cases in which a close contact for one central atom is desired
• if vdW radii are partially not perfectly suited for this approach, they could be corrected
• could be applied to the vdw radii in general

[marcelmbn]

We could also implement the following package.
https://github.com/MolSSI/QCElemental