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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-111371
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Fe', 'Te', 'S']
  • Chemical System: Fe-S-Te
  • Density: 6.379832570584805
  • Atomic Density: 0.04815736875785513
  • Unit Cell Volume: 166.12203295876895
  • Molar Volume: 12.505128322688325
  • Full Formula: Fe4 Te3 S1
  • Reduced Formula: Fe4Te3S
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm