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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21391
  • 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: 30
  • Number of elements: 4
  • Element list: ['K', 'Zr', 'Si', 'O']
  • Chemical System: K-O-Si-Zr
  • Density: 3.0590445812161655
  • Atomic Density: 0.06948695519029358
  • Unit Cell Volume: 431.7357109380238
  • Molar Volume: 8.666577407958169
  • Full Formula: K4 Zr2 Si6 O18
  • Reduced Formula: K2Zr(SiO3)3
  • Formula Anonymous: AB2C3D9
  • Spacegroup Number: 176
  • Spacegroup Symbol: P6_3/m
  • Crystal System: hexagonal
  • Pointgroup: 6/m