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  1. Third-Parties
  2. MatprojStructure
  3. mp-1078756

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-1078756
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 9
  • Number of elements: 3
  • Element list: ['Zr', 'Ga', 'Rh']
  • Chemical System: Ga-Rh-Zr
  • Density: 8.464621263316422
  • Atomic Density: 0.057958678517804195
  • Unit Cell Volume: 155.2830435434326
  • Molar Volume: 10.390403842886228
  • Full Formula: Zr3 Ga3 Rh3
  • Reduced Formula: ZrGaRh
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -64.23227965
  • Final energy per atom: -7.1369199611111105
  • 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.