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  1. Third-Parties
  2. MatprojStructure
  3. mp-1209200

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-1209200
  • 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: 24
  • Number of elements: 4
  • Element list: ['Re', 'H', 'N', 'O']
  • Chemical System: H-N-O-Re
  • Density: 5.9371967369986525
  • Atomic Density: 0.09158916049978562
  • Unit Cell Volume: 262.0397421380031
  • Molar Volume: 6.575167549454823
  • Full Formula: Re4 H8 N4 O8
  • Reduced Formula: ReH2NO2
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m

Thermodynamics:

  • Final energy: -147.48633732
  • Final energy per atom: -6.145264054999999
  • 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.