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  1. Third-Parties
  2. MatprojStructure
  3. mp-1196674

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-1196674
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 144
  • Number of elements: 5
  • Element list: ['Cs', 'Er', 'Si', 'O', 'F']
  • Chemical System: Cs-Er-F-O-Si
  • Density: 3.8735934717445986
  • Atomic Density: 0.05796374324354213
  • Unit Cell Volume: 2484.3116048417623
  • Molar Volume: 10.389495955596242
  • Full Formula: Cs16 Er8 Si32 O80 F8
  • Reduced Formula: Cs2ErSi4O10F
  • Formula Anonymous: ABC2D4E10
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -1113.5791317
  • Final energy per atom: -7.733188414583334
  • 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.