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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8795
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 7
  • Number of elements: 3
  • Element list: ['Zn', 'In', 'Se']
  • Chemical System: In-Se-Zn
  • Density: 5.2296985420989035
  • Atomic Density: 0.03608827608246891
  • Unit Cell Volume: 193.96881092362526
  • Molar Volume: 16.6872497490271
  • Full Formula: Zn1 In2 Se4
  • Reduced Formula: Zn(InSe2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m