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  1. Third-Parties
  2. MatprojStructure
  3. mp-1369676

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-1369676
  • 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: 30
  • Number of elements: 3
  • Element list: ['Y', 'Ag', 'O']
  • Chemical System: Ag-O-Y
  • Density: 5.69511684182237
  • Atomic Density: 0.07005858564022924
  • Unit Cell Volume: 428.213040926326
  • Molar Volume: 8.595864025753254
  • Full Formula: Y6 Ag6 O18
  • Reduced Formula: YAgO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 185
  • Spacegroup Symbol: P6_3cm
  • Crystal System: hexagonal
  • Pointgroup: 6mm

Thermodynamics:

  • Final energy: -209.78846761000003
  • Final energy per atom: -6.992948920333334
  • 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.