DFTD3

Input File	Description
dftd3/grad	DF-BP86-D2 cc-pVDZ frozen core gradient of S22 HCN, calling Grimme’s dftd3 program for -D2 gradients update reference for new BraggSlater radii
dftd3/energy	Exercises the various DFT-D corrections, both through python directly and through c++
dftd3/version	Exercises the various DFT-D corrections, both through python directly and through c++ all dft values updated to new BraggSlater radii
dftd3/nbody-cp-gradient	Computation of CP-corrected water trimer gradient (geometry from J. Chem. Theory Comput. 11, 2126-2136 (2015))
dftd3/psithon2	Accesses basis sets, databases, plugins, and executables in non-install locations