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  1. Third-Parties
  2. MatprojStructure
  3. mp-1181434

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-1181434
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Er', 'Co', 'B']
  • Chemical System: B-Co-Er
  • Density: 9.402628218887136
  • Atomic Density: 0.08541380592479604
  • Unit Cell Volume: 210.73876529806424
  • Molar Volume: 7.050547267853035
  • Full Formula: Er3 Co11 B4
  • Reduced Formula: Er3Co11B4
  • Formula Anonymous: A3B4C11
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm

Thermodynamics:

  • Final energy: -125.57386766
  • Final energy per atom: -6.976325981111112
  • 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.