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  1. Third-Parties
  2. MatprojStructure
  3. mp-23480

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-23480
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Bi', 'W', 'O']
  • Chemical System: Bi-O-W
  • Density: 8.948786802831055
  • Atomic Density: 0.06950696907189116
  • Unit Cell Volume: 517.9336760140576
  • Molar Volume: 8.664081948058028
  • Full Formula: Bi8 W4 O24
  • Reduced Formula: Bi2WO6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 29
  • Spacegroup Symbol: Pca2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -272.1397595
  • Final energy per atom: -7.55943776388889
  • 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.