Open AhmedCode99 opened 7 months ago
I really just estimated it, and seems to be... working out? I am getting energies at about 28 eV.
I estimated as well
same here.
initial coordinates for the cube I got them using the equilibrium distance either the theoretical one 2.312 A or the empirical one 2.36 A
I used the empirical value 0.236 nm
I really just estimated it, and seems to be... working out? I am getting energies at about 28 eV.