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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-60817
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['P', 'Pb', 'Au']
  • Chemical System: Au-P-Pb
  • Density: 10.191232112058765
  • Atomic Density: 0.04627870923934379
  • Unit Cell Volume: 216.0820853555378
  • Molar Volume: 13.012767337253832
  • Full Formula: P4 Pb2 Au4
  • Reduced Formula: P2PbAu2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm