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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95050
  • 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: 6
  • Number of elements: 3
  • Element list: ['Sc', 'Zn', 'Pt']
  • Chemical System: Pt-Sc-Zn
  • Density: 9.735598867450276
  • Atomic Density: 0.057583259733080795
  • Unit Cell Volume: 104.19694938793265
  • Molar Volume: 10.458144932945435
  • Full Formula: Sc2 Zn2 Pt2
  • Reduced Formula: ScZnPt
  • Formula Anonymous: ABC
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm