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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-13367
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 18
  • Number of elements: 3
  • Element list: ['Ca', 'Si', 'O']
  • Chemical System: Ca-O-Si
  • Density: 3.0513098186642944
  • Atomic Density: 0.07243399190616948
  • Unit Cell Volume: 248.50211242419283
  • Molar Volume: 8.31397055653241
  • Full Formula: Ca6 Si2 O10
  • Reduced Formula: Ca3SiO5
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm