Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-63235
  • 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: 15
  • Number of elements: 2
  • Element list: ['B', 'O']
  • Chemical System: B-O
  • Density: 2.518317271720483
  • Atomic Density: 0.10891710375638712
  • Unit Cell Volume: 137.71941671851854
  • Molar Volume: 5.529104752426773
  • Full Formula: B6 O9
  • Reduced Formula: B2O3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 152
  • Spacegroup Symbol: P3_121
  • Crystal System: trigonal
  • Pointgroup: 321