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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103679
  • 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: 10
  • Number of elements: 3
  • Element list: ['Ti', 'Al', 'Ge']
  • Chemical System: Al-Ge-Ti
  • Density: 3.9237087645803723
  • Atomic Density: 0.05864715057230736
  • Unit Cell Volume: 170.51126785214876
  • Molar Volume: 10.268428561717027
  • Full Formula: Ti2 Al6 Ge2
  • Reduced Formula: TiAl3Ge
  • Formula Anonymous: ABC3
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm