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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205265

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-1205265
  • 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: 44
  • Number of elements: 3
  • Element list: ['Na', 'As', 'O']
  • Chemical System: As-Na-O
  • Density: 2.2879222778001527
  • Atomic Density: 0.06089285643276588
  • Unit Cell Volume: 722.5806535875365
  • Molar Volume: 9.889732741720328
  • Full Formula: Na8 As4 O32
  • Reduced Formula: Na2AsO8
  • Formula Anonymous: AB2C8
  • Spacegroup Number: 18
  • Spacegroup Symbol: P2_12_12
  • Crystal System: orthorhombic
  • Pointgroup: 222

Thermodynamics:

  • Final energy: -221.26792464
  • Final energy per atom: -5.028816469090909
  • 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.