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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-113094
  • 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: 29
  • Number of elements: 4
  • Element list: ['K', 'La', 'P', 'Se']
  • Chemical System: K-La-P-Se
  • Density: 3.4386138387887297
  • Atomic Density: 0.03265600950560716
  • Unit Cell Volume: 888.0448174483962
  • Molar Volume: 18.441141006423262
  • Full Formula: K8 La1 P4 Se16
  • Reduced Formula: K8La(PSe4)4
  • Formula Anonymous: AB4C8D16
  • Spacegroup Number: 23
  • Spacegroup Symbol: I222
  • Crystal System: orthorhombic
  • Pointgroup: 222