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  1. Third-Parties
  2. MatprojStructure
  3. mp-1173728

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-1173728
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 40
  • Number of elements: 6
  • Element list: ['Na', 'Mn', 'Cd', 'Fe', 'P', 'O']
  • Chemical System: Cd-Fe-Mn-Na-O-P
  • Density: 3.851332001734183
  • Atomic Density: 0.08371694484509515
  • Unit Cell Volume: 477.80052263031837
  • Molar Volume: 7.193455006203357
  • Full Formula: Na4 Mn2 Cd2 Fe2 P6 O24
  • Reduced Formula: Na2MnCdFe(PO4)3
  • Formula Anonymous: ABCD2E3F12
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -291.49157549
  • Final energy per atom: -7.28728938725
  • 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.