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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100017
  • 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: 4
  • Number of elements: 3
  • Element list: ['Cr', 'Se', 'S']
  • Chemical System: Cr-S-Se
  • Density: 5.331269582436772
  • Atomic Density: 0.059726674640048695
  • Unit Cell Volume: 66.97175130051303
  • Molar Volume: 10.082832831885064
  • Full Formula: Cr2 Se1 S1
  • Reduced Formula: Cr2SeS
  • Formula Anonymous: ABC2
  • Spacegroup Number: 187
  • Spacegroup Symbol: P-6m2
  • Crystal System: hexagonal
  • Pointgroup: -6m2