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  1. Third-Parties
  2. MatprojStructure
  3. mp-1101935

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-1101935
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 4
  • Element list: ['Li', 'Mg', 'H', 'N']
  • Chemical System: H-Li-Mg-N
  • Density: 1.699977484016624
  • Atomic Density: 0.11596041053269003
  • Unit Cell Volume: 94.8599608217067
  • Molar Volume: 5.193273059603663
  • Full Formula: Li4 Mg1 H3 N3
  • Reduced Formula: Li4Mg(HN)3
  • Formula Anonymous: AB3C3D4
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -51.6009579
  • Final energy per atom: -4.690996172727273
  • 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.