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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205558

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-1205558
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Ho', 'B', 'Mo']
  • Chemical System: B-Ho-Mo
  • Density: 8.44596059354889
  • Atomic Density: 0.08670676411937932
  • Unit Cell Volume: 115.3312558894694
  • Molar Volume: 6.945410569939638
  • Full Formula: Ho2 B6 Mo2
  • Reduced Formula: HoB3Mo
  • Formula Anonymous: ABC3
  • Spacegroup Number: 11
  • Spacegroup Symbol: P12_1/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -77.21558506
  • Final energy per atom: -7.721558505999999
  • 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.