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Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

Database Entry ID: mp-1206248
Created at: Sept. 4, 2022, 2:45 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 8
Number of elements: 3
Element list: ['Nd', 'Ge', 'Ir']
Chemical System: Ge-Ir-Nd
Density: 10.434049482147064
Atomic Density: 0.04641338783349637
Unit Cell Volume: 172.36406074685266
Molar Volume: 12.975007947284219
Full Formula: Nd2 Ge3 Ir3
Reduced Formula: Nd2(GeIr)3
Formula Anonymous: A2B3C3
Spacegroup Number: 123
Spacegroup Symbol: P4/mmm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -44.38604348
Final energy per atom: -5.548255435
Energy above hull: None
Is thermodynamically stable?: None
Decomposes to: None
Formation energy None
Formation energy per atom: None

Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.