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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-680578
Created at: Sept. 4, 2022, 2:45 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 22
Number of elements: 3
Element list: ['Sm', 'Si', 'Pd']
Chemical System: Pd-Si-Sm
Density: 8.2345696240236
Atomic Density: 0.04908211675353068
Unit Cell Volume: 448.22842727982896
Molar Volume: 12.26952128051161
Full Formula: Sm8 Si6 Pd8
Reduced Formula: Sm4Si3Pd4
Formula Anonymous: A3B4C4
Spacegroup Number: 15
Spacegroup Symbol: C12/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -131.38349855
Final energy per atom: -5.971977206818182
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.