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  1. Third-Parties
  2. MatprojStructure
  3. mp-1207877

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-1207877
  • 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: 38
  • Number of elements: 3
  • Element list: ['Zn', 'S', 'O']
  • Chemical System: O-S-Zn
  • Density: 2.8232195305082035
  • Atomic Density: 0.062398937687068085
  • Unit Cell Volume: 608.9847264799724
  • Molar Volume: 9.65103090408551
  • Full Formula: Zn8 S2 O28
  • Reduced Formula: Zn4SO14
  • Formula Anonymous: AB4C14
  • Spacegroup Number: 147
  • Spacegroup Symbol: P-3
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -167.34936616000002
  • Final energy per atom: -4.403930688421053
  • 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.