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  1. Third-Parties
  2. MatprojStructure
  3. mp-1188248

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-1188248
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Mg', 'Ni', 'B', 'Ir']
  • Chemical System: B-Ir-Mg-Ni
  • Density: 14.042936714486277
  • Atomic Density: 0.07758507772736238
  • Unit Cell Volume: 257.7815294621595
  • Molar Volume: 7.761983278746056
  • Full Formula: Mg4 Ni2 B4 Ir10
  • Reduced Formula: Mg2NiB2Ir5
  • Formula Anonymous: AB2C2D5
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -140.70495529
  • Final energy per atom: -7.035247764499999
  • 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.