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-25203
  • 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: 24
  • Number of elements: 1
  • Element list: ['O']
  • Chemical System: O
  • Density: 1.927746197568808
  • Atomic Density: 0.07255996446945516
  • Unit Cell Volume: 330.7609116884703
  • Molar Volume: 8.299536533724574
  • Full Formula: O24
  • Reduced Formula: O
  • Formula Anonymous: A
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm