MMI Data HubUNC Charlotte
Back to search page

N2Y3

Structure

Open ASE's GUI
If the GUI button does not open remotely, use the 3D view above or download the structure.
Unit cell
Axis x y z Periodic
1 3.030 -1.749 0.000 True
2 0.000 3.499 0.000 True
3 0.000 0.000 8.712 True
Lengths: 3.4993.4998.712
Angles: 90.00090.000120.000

Interactive Convex Hull

Automatically generated for N-Y using the curated electride and Materials Project reference phases.

Binary
Generating convex hull for N-Y…
Hover for phase details, drag to zoom, and double-click to reset the view.

Properties

Key Description Value
N_excess N_excess 3.000
band0 band0 35.907
full_dft_e_hull full_dft_e_hull 0.021
composition composition Y3N2
e10 e10 46.846
space_group_number space_group_number 164
chemsys chemsys N-Y
electride electride True
volume Volume of unit cell 92.353 ų
e0025 e0025 0.000
mattersim_e_hull mattersim_e_hull 0.022
band1 band1 43.831
pearson_symbol pearson_symbol hP5
e05 e05 47.371
natoms Number of atoms 5
band_gap band_gap 0.000
dft_e_hull dft_e_hull -0.009
formula Chemical formula Y3N2