All Questions
Tagged with tight-binding density-functional-tight-binding
1 question
12
votes
0
answers
139
views
Orbital-free DFT and Density Functional Tight-Binding: Comparison [closed]
There are many flavors of DFT that are alternative to, or go beyond the Kohn-Sham formulation (KS-DFT).
Some of these are based on approximations that sacrifice accuracy when compared to KS-DFT, but ...