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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-108063
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Ti', 'Al', 'Cr', 'C']
  • Chemical System: Al-C-Cr-Ti
  • Density: 4.995706402331811
  • Atomic Density: 0.0853956030188688
  • Unit Cell Volume: 93.68163836529546
  • Molar Volume: 7.052050160790319
  • Full Formula: Ti1 Al2 Cr3 C2
  • Reduced Formula: TiAl2Cr3C2
  • Formula Anonymous: AB2C2D3
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1