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  1. Third-Parties
  2. MatprojStructure
  3. mp-1233552

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-1233552
  • 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: 29
  • Number of elements: 4
  • Element list: ['Mg', 'Hg', 'N', 'O']
  • Chemical System: Hg-Mg-N-O
  • Density: 6.047020261677065
  • Atomic Density: 0.05440707105710022
  • Unit Cell Volume: 533.0189520690151
  • Molar Volume: 11.068672955542421
  • Full Formula: Mg1 Hg8 N4 O16
  • Reduced Formula: MgHg8(NO4)4
  • Formula Anonymous: AB4C8D16
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -140.05857161999998
  • Final energy per atom: -4.829605917931034
  • 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.