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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-122137
  • 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: 14
  • Number of elements: 4
  • Element list: ['Ba', 'Cd', 'Si', 'O']
  • Chemical System: Ba-Cd-O-Si
  • Density: 5.473488966127321
  • Atomic Density: 0.0651279872552505
  • Unit Cell Volume: 214.96134903004153
  • Molar Volume: 9.246625012988568
  • Full Formula: Ba3 Cd1 Si2 O8
  • Reduced Formula: Ba3Cd(SiO4)2
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1