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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95230
  • 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: 48
  • Number of elements: 4
  • Element list: ['K', 'H', 'Se', 'O']
  • Chemical System: H-K-O-Se
  • Density: 3.1503826665878294
  • Atomic Density: 0.07690369971831665
  • Unit Cell Volume: 624.1572274911962
  • Molar Volume: 7.830755584006926
  • Full Formula: K4 H12 Se8 O24
  • Reduced Formula: KH3(SeO3)2
  • Formula Anonymous: AB2C3D6
  • Spacegroup Number: 60
  • Spacegroup Symbol: Pbcn
  • Crystal System: orthorhombic
  • Pointgroup: mmm