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  1. Third-Parties
  2. MatprojStructure
  3. mp-37537

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-37537
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['Li', 'Mn', 'Br']
  • Chemical System: Br-Li-Mn
  • Density: 8.634973596694984
  • Atomic Density: 0.0937109699315
  • Unit Cell Volume: 298.79105957890727
  • Molar Volume: 6.426292209334735
  • Full Formula: Li8 Mn4 Br16
  • Reduced Formula: Li2MnBr4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 91
  • Spacegroup Symbol: P4_122
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -56.23667005999999
  • Final energy per atom: -2.0084525021428568
  • 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.