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  1. Third-Parties
  2. MatprojStructure
  3. mp-1200942

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-1200942
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 54
  • Number of elements: 3
  • Element list: ['Er', 'B', 'Rh']
  • Chemical System: B-Er-Rh
  • Density: 9.751504145053579
  • Atomic Density: 0.0849546916506766
  • Unit Cell Volume: 635.6329350477954
  • Molar Volume: 7.088650012129188
  • Full Formula: Er6 B24 Rh24
  • Reduced Formula: Er(BRh)4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 68
  • Spacegroup Symbol: Ccce1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -395.87963255
  • Final energy per atom: -7.331104306481482
  • 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.