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  1. Third-Parties
  2. MatprojStructure
  3. mp-1203289

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-1203289
  • 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: 128
  • Number of elements: 4
  • Element list: ['Cs', 'Ge', 'Sb', 'O']
  • Chemical System: Cs-Ge-O-Sb
  • Density: 4.899213769818143
  • Atomic Density: 0.05794957493182911
  • Unit Cell Volume: 2208.8168921096835
  • Molar Volume: 10.392036122929882
  • Full Formula: Cs16 Ge16 Sb16 O80
  • Reduced Formula: CsGeSbO5
  • Formula Anonymous: ABCD5
  • Spacegroup Number: 98
  • Spacegroup Symbol: I4_122
  • Crystal System: tetragonal
  • Pointgroup: 422

Thermodynamics:

  • Final energy: -817.4698550100001
  • Final energy per atom: -6.3864832422656255
  • 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.