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  1. Third-Parties
  2. MatprojStructure
  3. mp-1186662

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-1186662
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Pu', 'Ga', 'O']
  • Chemical System: Ga-O-Pu
  • Density: 10.336598193475862
  • Atomic Density: 0.08604478991303952
  • Unit Cell Volume: 58.10927082340733
  • Molar Volume: 6.9988441671904
  • Full Formula: Pu1 Ga1 O3
  • Reduced Formula: PuGaO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -45.52578265
  • Final energy per atom: -9.105156529999999
  • 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.