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  1. Third-Parties
  2. MatprojStructure
  3. mp-542909

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-542909
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 20
  • Number of elements: 1
  • Element list: ['Mn']
  • Chemical System: Mn
  • Density: 8.32925983772251
  • Atomic Density: 0.09130280334277263
  • Unit Cell Volume: 219.0513244693616
  • Molar Volume: 6.595789548094639
  • Full Formula: Mn20
  • Reduced Formula: Mn
  • Formula Anonymous: A
  • Spacegroup Number: 213
  • Spacegroup Symbol: P4_132
  • Crystal System: cubic
  • Pointgroup: 432

Thermodynamics:

  • Final energy: -182.18136604
  • Final energy per atom: -9.109068302
  • 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.