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-119704
  • 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: 14
  • Number of elements: 4
  • Element list: ['Co', 'P', 'O', 'F']
  • Chemical System: Co-F-O-P
  • Density: 3.819960250357787
  • Atomic Density: 0.09313337848362915
  • Unit Cell Volume: 150.3220459511291
  • Molar Volume: 6.466146571777768
  • Full Formula: Co2 P2 O8 F2
  • Reduced Formula: CoPO4F
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1