Tight-Binding parameters for Ruthenium


Ruthenium (Ru)
Atomic Number 44
Atomic Weight 101.07
Room Temperature Structure hcp (A3)
Room Temperature Lattice Constant a 0.271 nm
Room Temperature Lattice Constant c 0.428 nm

The tight-binding parameters were fit to first-principles Augmented Plane Wave (APW) results over the following ranges:

Structure Minimum Lattice Constant (Bohr) Maximum Lattice Constant (Bohr)
fcc (A1)  6.80   7.40 
bcc (A2)  5.50   5.90 
Reference Phys. Rev. B 54, 4519-30 (1996)

Use of the parameters outside of these ranges may result in unphysical behavior.

Get the parameters (ru_par).


Return to the tight-binding parameters periodic table