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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57165
  • 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: 14
  • Number of elements: 4
  • Element list: ['Ba', 'Ca', 'Ga', 'O']
  • Chemical System: Ba-Ca-Ga-O
  • Density: 4.859769323655477
  • Atomic Density: 0.070123648601874
  • Unit Cell Volume: 199.64734121986146
  • Molar Volume: 8.587888508469685
  • Full Formula: Ba1 Ca1 Ga4 O8
  • Reduced Formula: BaCa(GaO2)4
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 44
  • Spacegroup Symbol: Imm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2