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  1. Third-Parties
  2. MatprojStructure
  3. mp-1193208

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-1193208
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 28
  • Number of elements: 2
  • Element list: ['K', 'Hg']
  • Chemical System: Hg-K
  • Density: 9.36985662229539
  • Atomic Density: 0.03178609322599068
  • Unit Cell Volume: 880.8883747029696
  • Molar Volume: 18.945834951103237
  • Full Formula: K4 Hg24
  • Reduced Formula: KHg6
  • Formula Anonymous: AB6
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -16.0126232
  • Final energy per atom: -0.5718794
  • 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.