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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-864665
Created at: Sept. 4, 2022, 2:48 p.m.
Last updated at: Nov. 28, 2021, 1:39 a.m.
Input Source: Materials Project

Structure:

Number of sites: 24
Number of elements: 3
Element list: ['Nd', 'Si', 'Rh']
Chemical System: Nd-Rh-Si
Density: 6.347156366895192
Atomic Density: 0.04821670201836945
Unit Cell Volume: 497.7528324284094
Molar Volume: 12.48974008571906
Full Formula: Nd8 Si12 Rh4
Reduced Formula: Nd2Si3Rh
Formula Anonymous: AB2C3
Spacegroup Number: 194
Spacegroup Symbol: P6_3/mmc
Crystal System: hexagonal
Pointgroup: 6/mmm

Thermodynamics:

Final energy: -154.3578179
Final energy per atom: -6.4315757458333325
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.