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  1. Third-Parties
  2. MatprojStructure
  3. mp-801915

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-801915
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 3
  • Element list: ['Al', 'Fe', 'O']
  • Chemical System: Al-Fe-O
  • Density: 4.192819011277528
  • Atomic Density: 0.09962495214173969
  • Unit Cell Volume: 562.1081746702067
  • Molar Volume: 6.044811696804734
  • Full Formula: Al15 Fe9 O32
  • Reduced Formula: Al15Fe9O32
  • Formula Anonymous: A9B15C32
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -380.6081702
  • Final energy per atom: -6.796574467857143
  • 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.