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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91816
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ba', 'Sr', 'O']
  • Chemical System: Ba-O-Sr
  • Density: 5.627060752468374
  • Atomic Density: 0.048100831944077466
  • Unit Cell Volume: 166.31728967392672
  • Molar Volume: 12.519826615476015
  • Full Formula: Ba3 Sr1 O4
  • Reduced Formula: Ba3SrO4
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m