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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29343
  • 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: 7
  • Number of elements: 3
  • Element list: ['Zn', 'In', 'S']
  • Chemical System: In-S-Zn
  • Density: 4.278522632296292
  • Atomic Density: 0.04260782622885789
  • Unit Cell Volume: 164.2890665766695
  • Molar Volume: 14.133884060767357
  • Full Formula: Zn1 In2 S4
  • Reduced Formula: Zn(InS2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m