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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-93769
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Ti', 'Ge', 'Sb']
  • Chemical System: Ge-Sb-Ti
  • Density: 6.966687221802119
  • Atomic Density: 0.05195223174648331
  • Unit Cell Volume: 115.49070748834858
  • Molar Volume: 11.591688282780353
  • Full Formula: Ti2 Ge2 Sb2
  • Reduced Formula: TiGeSb
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm