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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57811
  • 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: 27
  • Number of elements: 3
  • Element list: ['Ca', 'Si', 'O']
  • Chemical System: Ca-O-Si
  • Density: 3.0470094476718126
  • Atomic Density: 0.07233190688164737
  • Unit Cell Volume: 373.2792506656652
  • Molar Volume: 8.325704408503555
  • Full Formula: Ca9 Si3 O15
  • Reduced Formula: Ca3SiO5
  • Formula Anonymous: AB3C5
  • Spacegroup Number: 160
  • Spacegroup Symbol: R3mH
  • Crystal System: trigonal
  • Pointgroup: 3m