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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55342
  • 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: 21
  • Number of elements: 4
  • Element list: ['Ba', 'Mn', 'B', 'O']
  • Chemical System: B-Ba-Mn-O
  • Density: 3.916899060120509
  • Atomic Density: 0.08446581184635997
  • Unit Cell Volume: 248.62130062987123
  • Molar Volume: 7.129678420606481
  • Full Formula: Ba2 Mn1 B6 O12
  • Reduced Formula: Ba2Mn(BO2)6
  • Formula Anonymous: AB2C6D12
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3