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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29546
  • 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: 6
  • Number of elements: 2
  • Element list: ['Cr', 'I']
  • Chemical System: Cr-I
  • Density: 5.954347552574099
  • Atomic Density: 0.035177234921917364
  • Unit Cell Volume: 170.56485574600032
  • Molar Volume: 17.119426166858478
  • Full Formula: Cr2 I4
  • Reduced Formula: CrI2
  • Formula Anonymous: AB2
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm