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  1. Third-Parties
  2. MatprojStructure
  3. mp-1226455

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-1226455
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 4
  • Element list: ['Cs', 'Ge', 'B', 'O']
  • Chemical System: B-Cs-Ge-O
  • Density: 3.590812296602035
  • Atomic Density: 0.06581642416380085
  • Unit Cell Volume: 243.1004145740271
  • Molar Volume: 9.149905721119667
  • Full Formula: Cs2 Ge1 B4 O9
  • Reduced Formula: Cs2GeB4O9
  • Formula Anonymous: AB2C4D9
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -120.19025294
  • Final energy per atom: -7.51189080875
  • 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.