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  1. Third-Parties
  2. MatprojStructure
  3. mp-1211169

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-1211169
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 56
  • Number of elements: 5
  • Element list: ['Mn', 'Al', 'P', 'H', 'O']
  • Chemical System: Al-H-Mn-O-P
  • Density: 2.7977921638532393
  • Atomic Density: 0.1030407313192126
  • Unit Cell Volume: 543.4744035978949
  • Molar Volume: 5.844427424863524
  • Full Formula: Mn4 Al4 P4 H16 O28
  • Reduced Formula: MnAlPH4O7
  • Formula Anonymous: ABCD4E7
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -381.1454488
  • Final energy per atom: -6.8061687285714285
  • 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.