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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109138
  • 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: 9
  • Number of elements: 3
  • Element list: ['Ti', 'Fe', 'P']
  • Chemical System: Fe-P-Ti
  • Density: 5.586813276340682
  • Atomic Density: 0.07644963883677697
  • Unit Cell Volume: 117.72455876757455
  • Molar Volume: 7.8772651534136235
  • Full Formula: Ti4 Fe2 P3
  • Reduced Formula: Ti4Fe2P3
  • Formula Anonymous: A2B3C4
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2