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-8301
  • 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: 8
  • Number of elements: 3
  • Element list: ['Mg', 'Mo', 'F']
  • Chemical System: F-Mg-Mo
  • Density: 3.6854736401186305
  • Atomic Density: 0.07580216898549698
  • Unit Cell Volume: 105.53787717513227
  • Molar Volume: 7.944549398252971
  • Full Formula: Mg1 Mo1 F6
  • Reduced Formula: MgMoF6
  • Formula Anonymous: ABC6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3