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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-115213
  • 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: 6
  • Number of elements: 3
  • Element list: ['Li', 'Ti', 'P']
  • Chemical System: Li-P-Ti
  • Density: 2.7000798933027252
  • Atomic Density: 0.07468112080722225
  • Unit Cell Volume: 80.34159015218948
  • Molar Volume: 8.063806079645246
  • Full Formula: Li3 Ti1 P2
  • Reduced Formula: Li3TiP2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1