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  1. Third-Parties
  2. MatprojStructure
  3. mp-769405

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-769405
  • 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: 33
  • Number of elements: 3
  • Element list: ['Ho', 'Bi', 'O']
  • Chemical System: Bi-Ho-O
  • Density: 8.966516830138778
  • Atomic Density: 0.05954261119332776
  • Unit Cell Volume: 554.2249380507169
  • Molar Volume: 10.114001786799083
  • Full Formula: Ho1 Bi12 O20
  • Reduced Formula: Ho(Bi3O5)4
  • Formula Anonymous: AB12C20
  • Spacegroup Number: 197
  • Spacegroup Symbol: I23
  • Crystal System: cubic
  • Pointgroup: 23

Thermodynamics:

  • Final energy: -208.04144209
  • Final energy per atom: -6.304286123939394
  • 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.