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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-51399
  • 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: 16
  • Number of elements: 5
  • Element list: ['Na', 'Ca', 'Si', 'H', 'O']
  • Chemical System: Ca-H-Na-O-Si
  • Density: 2.7477953411489313
  • Atomic Density: 0.08477324029856785
  • Unit Cell Volume: 188.7388041750989
  • Molar Volume: 7.103822785103258
  • Full Formula: Na2 Ca2 Si2 H2 O8
  • Reduced Formula: NaCaSiHO4
  • Formula Anonymous: ABCDE4
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2