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  1. Third-Parties
  2. MatprojStructure
  3. mp-550479

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-550479
  • Created at: Sept. 4, 2022, 2:44 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 22
  • Number of elements: 3
  • Element list: ['Co', 'Re', 'O']
  • Chemical System: Co-O-Re
  • Density: 4.776586351016438
  • Atomic Density: 0.05656964890862969
  • Unit Cell Volume: 388.9011232071462
  • Molar Volume: 10.645533207616078
  • Full Formula: Co2 Re4 O16
  • Reduced Formula: Co(ReO4)2
  • Formula Anonymous: AB2C8
  • Spacegroup Number: 147
  • Spacegroup Symbol: P-3
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -188.00073514
  • Final energy per atom: -8.54548796090909
  • 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.