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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-86187
  • 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: 4
  • Element list: ['K', 'Sn', 'Hg', 'Se']
  • Chemical System: Hg-K-Se-Sn
  • Density: 5.152809405290404
  • Atomic Density: 0.03480089882822144
  • Unit Cell Volume: 229.87912006205082
  • Molar Volume: 17.304555234982622
  • Full Formula: K2 Sn1 Hg1 Se4
  • Reduced Formula: K2SnHgSe4
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m