Au10Si4

Axis x y z Periodic
1 11.502 0.000 0.000 True
2 0.000 7.462 0.000 True
3 0.000 0.000 20.000 True
Lengths: 11.502 7.462 20.000
Angles: 90.000 90.000 90.000
band structure
dos
Key Value
Uniqe row ID 2029
Total energy -50.017 eV
Maximum force 0.006 eV/Ang
Maximum stress on unit cell 0.001 eV/Ang3
Sum of atomic masses in unit cell 2082.006 au
Age 43.862 months
Items
Au_rate 0.714
E 0.262
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 36e82a0536fe39f5c0e2e47a7c0f5790
Username yangxb
Volume of unit cell 1716.536 Ang3