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-13868
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 27
  • Number of elements: 3
  • Element list: ['Na', 'Si', 'F']
  • Chemical System: F-Na-Si
  • Density: 2.8179440056334375
  • Atomic Density: 0.08121566955488371
  • Unit Cell Volume: 332.44816114892717
  • Molar Volume: 7.414998599414825
  • Full Formula: Na6 Si3 F18
  • Reduced Formula: Na2SiF6
  • Formula Anonymous: AB2C6
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1