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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216004

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-1216004
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 4
  • Element list: ['Y', 'Th', 'B', 'Rh']
  • Chemical System: B-Rh-Th-Y
  • Density: 9.400542795824554
  • Atomic Density: 0.08280043892429939
  • Unit Cell Volume: 217.39015195869393
  • Molar Volume: 7.273078305183582
  • Full Formula: Y1 Th1 B8 Rh8
  • Reduced Formula: YTh(BRh)8
  • Formula Anonymous: ABC8D8
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -136.65294245
  • Final energy per atom: -7.591830136111112
  • 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.