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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222100

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-1222100
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Mg', 'Te', 'S']
  • Chemical System: Mg-S-Te
  • Density: 3.394966241644515
  • Atomic Density: 0.03193995463986921
  • Unit Cell Volume: 250.46998626647886
  • Molar Volume: 18.85456891815003
  • Full Formula: Mg4 Te3 S1
  • Reduced Formula: Mg4Te3S
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -29.569274210000003
  • Final energy per atom: -3.6961592762500004
  • 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.