Au10Si4

Axis x y z Periodic
1 9.279 0.000 0.000 True
2 -0.000 9.280 0.000 True
3 0.000 0.000 20.000 True
Lengths: 9.279 9.280 20.000
Angles: 90.000 90.000 90.000
band structure
dos
Key Value
Uniqe row ID 1911
Total energy -50.376 eV
Maximum force 0.009 eV/Ang
Maximum stress on unit cell 0.000 eV/Ang3
Sum of atomic masses in unit cell 2082.006 au
Age 43.881 months
Items
Au_rate 0.714
E 0.236
Si_rate 0.286
ASE-calculator name vasp
Net charge in unit cell 0.000 |e|
Chemical formula Au10Si4
Number of atoms 14
Periodic boundary conditions [ True True True]
Random (unique) ID 967e36d4e1a6ee74af07da1d53d215c5
Username yangxb
Volume of unit cell 1722.124 Ang3