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  1. Third-Parties
  2. MatprojStructure
  3. mp-1195414

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-1195414
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 93
  • Number of elements: 5
  • Element list: ['Mn', 'Be', 'Fe', 'P', 'O']
  • Chemical System: Be-Fe-Mn-O-P
  • Density: 2.2730298187565077
  • Atomic Density: 0.06424249261514721
  • Unit Cell Volume: 1447.6399687217663
  • Molar Volume: 9.374077055316638
  • Full Formula: Mn3 Be6 Fe6 P12 O66
  • Reduced Formula: MnBe2Fe2(P2O11)2
  • Formula Anonymous: AB2C2D4E22
  • Spacegroup Number: 144
  • Spacegroup Symbol: P3_1
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -626.6441230199999
  • Final energy per atom: -6.738108849677419
  • 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.