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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-69638
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['K', 'Ca', 'Be']
  • Chemical System: Be-Ca-K
  • Density: 1.927164647206046
  • Atomic Density: 0.04775957817399773
  • Unit Cell Volume: 83.75283352434975
  • Molar Volume: 12.609283813312027
  • Full Formula: K1 Ca1 Be2
  • Reduced Formula: KCaBe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m