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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35798
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 2
  • Element list: ['Al', 'Tc']
  • Chemical System: Al-Tc
  • Density: 8.683940938121669
  • Atomic Density: 0.0703590732586785
  • Unit Cell Volume: 42.63842403054907
  • Molar Volume: 8.559153043217767
  • Full Formula: Al1 Tc2
  • Reduced Formula: AlTc2
  • Formula Anonymous: AB2
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm