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N2Li9

Structure

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Unit cell
Axis x y z Periodic
1 3.099 -1.789 0.000 True
2 0.000 3.578 0.000 True
3 0.000 0.000 15.310 True
Lengths: 3.5783.57815.310
Angles: 90.00090.000120.000

Interactive Convex Hull

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

Binary
Generating convex hull for Li-N…
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Properties

Key Description Value
N_excess N_excess 3.000
band0 band0 24.291
full_dft_e_hull full_dft_e_hull 0.024
composition composition Li9N2
e10 e10 20.605
space_group_number space_group_number 156
chemsys chemsys Li-N
electride electride True
volume Volume of unit cell 169.776 ų
e0025 e0025 19.388
mattersim_e_hull mattersim_e_hull 0.039
band1 band1 42.618
pearson_symbol pearson_symbol hP11
e05 e05 30.474
natoms Number of atoms 11
band_gap band_gap 0.000
dft_e_hull dft_e_hull 0.020
formula Chemical formula Li9N2