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  1. Third-Parties
  2. MatprojStructure
  3. mp-976293

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-976293
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Na', 'Cd', 'O']
  • Chemical System: Cd-Na-O
  • Density: 3.948630055695392
  • Atomic Density: 0.06482917026779345
  • Unit Cell Volume: 77.1257750075502
  • Molar Volume: 9.289245466391147
  • Full Formula: Na1 Cd1 O3
  • Reduced Formula: NaCdO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -20.18643129
  • Final energy per atom: -4.037286258
  • 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.