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-31824
  • 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: 48
  • Number of elements: 2
  • Element list: ['Au', 'F']
  • Chemical System: Au-F
  • Density: 5.851279920957295
  • Atomic Density: 0.07241554069528816
  • Unit Cell Volume: 662.8411462392519
  • Molar Volume: 8.316088925359416
  • Full Formula: Au8 F40
  • Reduced Formula: AuF5
  • Formula Anonymous: AB5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm