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  1. Third-Parties
  2. MatprojStructure
  3. mp-760405

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-760405
  • 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: 10
  • Number of elements: 3
  • Element list: ['Er', 'B', 'O']
  • Chemical System: B-Er-O
  • Density: 6.405482703178708
  • Atomic Density: 0.08531655157076068
  • Unit Cell Volume: 117.21055077696268
  • Molar Volume: 7.058584353359966
  • Full Formula: Er2 B2 O6
  • Reduced Formula: ErBO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 40
  • Spacegroup Symbol: Ama2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -86.92274710999999
  • Final energy per atom: -8.692274711
  • 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.