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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107018
  • 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: 8
  • Number of elements: 5
  • Element list: ['Zn', 'Cu', 'Sn', 'Se', 'S']
  • Chemical System: Cu-S-Se-Sn-Zn
  • Density: 5.03137566773563
  • Atomic Density: 0.045455643668693375
  • Unit Cell Volume: 175.995747817555
  • Molar Volume: 13.248389581484739
  • Full Formula: Zn1 Cu2 Sn1 Se2 S2
  • Reduced Formula: ZnCu2Sn(SeS)2
  • Formula Anonymous: ABC2D2E2
  • Spacegroup Number: 42
  • Spacegroup Symbol: Fmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2