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  1. Third-Parties
  2. MatprojStructure
  3. mp-555965

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-555965
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 84
  • Number of elements: 4
  • Element list: ['Li', 'Zn', 'Sn', 'O']
  • Chemical System: Li-O-Sn-Zn
  • Density: 5.65985910947127
  • Atomic Density: 0.08469450390509954
  • Unit Cell Volume: 991.7998940536007
  • Molar Volume: 7.110426866361751
  • Full Formula: Li12 Zn6 Sn18 O48
  • Reduced Formula: Li2ZnSn3O8
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 36
  • Spacegroup Symbol: Cmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -519.80404818
  • Final energy per atom: -6.188143430714286
  • 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.