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  1. Third-Parties
  2. MatprojStructure
  3. mp-555027

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-555027
  • 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: 40
  • Number of elements: 4
  • Element list: ['Cd', 'Ge', 'Bi', 'O']
  • Chemical System: Bi-Cd-Ge-O
  • Density: 7.4215741306672305
  • Atomic Density: 0.06393882659902687
  • Unit Cell Volume: 625.5979680523068
  • Molar Volume: 9.418597556952436
  • Full Formula: Cd4 Ge4 Bi8 O24
  • Reduced Formula: CdGe(BiO3)2
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -243.43033496
  • Final energy per atom: -6.085758374
  • 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.