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  1. Third-Parties
  2. MatprojStructure
  3. mp-704227

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-704227
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 49
  • Number of elements: 3
  • Element list: ['Mn', 'P', 'O']
  • Chemical System: Mn-O-P
  • Density: 3.2186110780606487
  • Atomic Density: 0.07572583696856124
  • Unit Cell Volume: 647.0710917377264
  • Molar Volume: 7.952557543207063
  • Full Formula: Mn9 P8 O32
  • Reduced Formula: Mn9(PO4)8
  • Formula Anonymous: A8B9C32
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -403.01756467
  • Final energy per atom: -8.224848258571429
  • 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.