Density Functionals from the Truhlar Group

Our information about functionals is organized both by program and by functional.

This page contains the density functionals developed in the Truhlar group on the second, third, and fourth rungs of the ladder of functionals; our fifth-rung functionals (that is, functionals involving unoccupied orbitals (22,23)) are not considered here. The functionals considered here are classified into 11 categories: