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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-9229
  • 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: 18
  • Number of elements: 3
  • Element list: ['Ca', 'Bi', 'O']
  • Chemical System: Bi-Ca-O
  • Density: 6.765556043818531
  • Atomic Density: 0.06618499645268296
  • Unit Cell Volume: 271.96496131670233
  • Molar Volume: 9.098951549095203
  • Full Formula: Ca2 Bi4 O12
  • Reduced Formula: Ca(BiO3)2
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 31
  • Spacegroup Symbol: Pmn2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2