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  1. Third-Parties
  2. MatprojStructure
  3. mp-1210594

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-1210594
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 52
  • Number of elements: 4
  • Element list: ['Na', 'Er', 'Re', 'O']
  • Chemical System: Er-Na-O-Re
  • Density: 4.6747323109769665
  • Atomic Density: 0.05831964325358726
  • Unit Cell Volume: 891.6378273078936
  • Molar Volume: 10.326093274978284
  • Full Formula: Na2 Er2 Re8 O40
  • Reduced Formula: NaEr(ReO5)4
  • Formula Anonymous: ABC4D20
  • Spacegroup Number: 118
  • Spacegroup Symbol: P-4n2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -393.49354964
  • Final energy per atom: -7.567183646923078
  • 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.