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  1. Third-Parties
  2. MatprojStructure
  3. mp-1188588

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-1188588
  • 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: ['Pr', 'B', 'Os']
  • Chemical System: B-Os-Pr
  • Density: 13.446431463186789
  • Atomic Density: 0.07711444176437686
  • Unit Cell Volume: 233.41931275336196
  • Molar Volume: 7.809355319462272
  • Full Formula: Pr2 B8 Os8
  • Reduced Formula: Pr(BOs)4
  • Formula Anonymous: AB4C4
  • Spacegroup Number: 86
  • Spacegroup Symbol: P4_2/n
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -159.56710255
  • Final energy per atom: -8.864839030555554
  • 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.