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  1. Third-Parties
  2. MatprojStructure
  3. mp-737304

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-737304
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 124
  • Number of elements: 3
  • Element list: ['Mn', 'Si', 'O']
  • Chemical System: Mn-O-Si
  • Density: 4.090804363299956
  • Atomic Density: 0.0853509073821827
  • Unit Cell Volume: 1452.8257965056553
  • Molar Volume: 7.055743101867881
  • Full Formula: Mn36 Si16 O72
  • Reduced Formula: Mn9(Si2O9)2
  • Formula Anonymous: A4B9C18
  • Spacegroup Number: 33
  • Spacegroup Symbol: Pna2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -1082.01113638
  • Final energy per atom: -8.725896261129032
  • 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.