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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-16225
Created at: Sept. 4, 2022, 2:39 p.m.
Last updated at: Nov. 28, 2021, 1:34 a.m.
Input Source: Materials Project

Structure:

Number of sites: 14
Number of elements: 3
Element list: ['Y', 'Si', 'Rh']
Chemical System: Rh-Si-Y
Density: 5.28299206486687
Atomic Density: 0.04906686212610841
Unit Cell Volume: 285.32495035077085
Molar Volume: 12.273335809659667
Full Formula: Y6 Si6 Rh2
Reduced Formula: Y3Si3Rh
Formula Anonymous: AB3C3
Spacegroup Number: 12
Spacegroup Symbol: C12/m1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -98.89890726
Final energy per atom: -7.064207661428571
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.