- Functional : LDA Ceperley/Alder Perdew/Zunger (1980)
- orbitals : spd (Weighted Löwdin)
- Autor : Daniel.G.Trabada
- method : charge_Tis175800p000800d130800 automatic generation
- cristal = fcc
- E_min = -96.03
- a_min = 4.128 angs
- Bulk modulus = 116 GPa
- read more