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-111753
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 19
  • Number of elements: 4
  • Element list: ['Ba', 'Y', 'Co', 'O']
  • Chemical System: Ba-Co-O-Y
  • Density: 6.405537629711865
  • Atomic Density: 0.08481055572932646
  • Unit Cell Volume: 224.02871714033625
  • Molar Volume: 7.10069720474384
  • Full Formula: Ba2 Y2 Co4 O11
  • Reduced Formula: Ba2Y2Co4O11
  • Formula Anonymous: A2B2C4D11
  • Spacegroup Number: 47
  • Spacegroup Symbol: Pmmm
  • Crystal System: orthorhombic
  • Pointgroup: mmm