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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-17788
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ti', 'Pb', 'C']
  • Chemical System: C-Pb-Ti
  • Density: 8.307050740106025
  • Atomic Density: 0.06353652418938138
  • Unit Cell Volume: 125.9118294881011
  • Molar Volume: 9.478234506580796
  • Full Formula: Ti4 Pb2 C2
  • Reduced Formula: Ti2PbC
  • Formula Anonymous: ABC2
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm