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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-1594
  • 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: 4
  • Number of elements: 3
  • Element list: ['K', 'Sc', 'O']
  • Chemical System: K-O-Sc
  • Density: 3.494196867568963
  • Atomic Density: 0.07252735633237413
  • Unit Cell Volume: 55.151603509012986
  • Molar Volume: 8.303267986774653
  • Full Formula: K1 Sc1 O2
  • Reduced Formula: KScO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m