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  1. Third-Parties
  2. MatprojStructure
  3. mp-1224491

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-1224491
  • 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: 54
  • Number of elements: 3
  • Element list: ['K', 'Sn', 'Hg']
  • Chemical System: Hg-K-Sn
  • Density: 5.244442779335196
  • Atomic Density: 0.02795409137698531
  • Unit Cell Volume: 1931.7386951256217
  • Molar Volume: 21.542967284417074
  • Full Formula: K8 Sn42 Hg4
  • Reduced Formula: K4Sn21Hg2
  • Formula Anonymous: A2B4C21
  • Spacegroup Number: 40
  • Spacegroup Symbol: Ama2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -186.19943456
  • Final energy per atom: -3.4481376770370367
  • 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.