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  1. Third-Parties
  2. MatprojStructure
  3. mp-1077275

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-1077275
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Re', 'N']
  • Chemical System: N-Re
  • Density: 12.054549385485982
  • Atomic Density: 0.10166285735091768
  • Unit Cell Volume: 59.018604791810326
  • Molar Volume: 5.923639091918204
  • Full Formula: Re2 N4
  • Reduced Formula: ReN2
  • Formula Anonymous: AB2
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -57.11683047
  • Final energy per atom: -9.519471744999999
  • 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.