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-12772
  • 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: 16
  • Number of elements: 3
  • Element list: ['Na', 'S', 'O']
  • Chemical System: Na-O-S
  • Density: 2.441480587300523
  • Atomic Density: 0.06755812489351953
  • Unit Cell Volume: 236.8330977986452
  • Molar Volume: 8.914014072314298
  • Full Formula: Na4 S4 O8
  • Reduced Formula: NaSO2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m