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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29982
  • 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: 36
  • Number of elements: 3
  • Element list: ['Re', 'Se', 'Cl']
  • Chemical System: Cl-Re-Se
  • Density: 6.626269080380971
  • Atomic Density: 0.03982202627517801
  • Unit Cell Volume: 904.0223054254684
  • Molar Volume: 15.122637704033007
  • Full Formula: Re12 Se12 Cl12
  • Reduced Formula: ReSeCl
  • Formula Anonymous: ABC
  • Spacegroup Number: 20
  • Spacegroup Symbol: C222_1
  • Crystal System: orthorhombic
  • Pointgroup: 222