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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216172

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-1216172
  • 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: 28
  • Number of elements: 5
  • Element list: ['Y', 'Mn', 'Al', 'B', 'O']
  • Chemical System: Al-B-Mn-O-Y
  • Density: 3.9774621990322436
  • Atomic Density: 0.0893332396831584
  • Unit Cell Volume: 313.43316440004486
  • Molar Volume: 6.7412094102474684
  • Full Formula: Y2 Mn4 Al2 B4 O16
  • Reduced Formula: YMn2Al(BO4)2
  • Formula Anonymous: ABC2D2E8
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -244.72019086
  • Final energy per atom: -8.740006816428572
  • 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.