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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216341

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-1216341
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 69
  • Number of elements: 6
  • Element list: ['Zn', 'Si', 'Te', 'P', 'Pb', 'O']
  • Chemical System: O-P-Pb-Si-Te-Zn
  • Density: 6.115393309632211
  • Atomic Density: 0.06889624870666948
  • Unit Cell Volume: 1001.5059062761493
  • Molar Volume: 8.740883390675853
  • Full Formula: Zn9 Si2 Te3 P4 Pb9 O42
  • Reduced Formula: Zn9Si2Te3P4(Pb3O14)3
  • Formula Anonymous: A2B3C4D9E9F42
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2

Thermodynamics:

  • Final energy: -435.82253263
  • Final energy per atom: -6.31626858884058
  • 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.