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  1. Third-Parties
  2. MatprojStructure
  3. mp-1196563

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-1196563
  • 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: 150
  • Number of elements: 3
  • Element list: ['Gd', 'B', 'O']
  • Chemical System: B-Gd-O
  • Density: 5.93003192014094
  • Atomic Density: 0.10676322375851571
  • Unit Cell Volume: 1404.978181806126
  • Molar Volume: 5.640650917043575
  • Full Formula: Gd20 B40 O90
  • Reduced Formula: Gd2B4O9
  • Formula Anonymous: A2B4C9
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -1481.16276771
  • Final energy per atom: -9.8744184514
  • 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.