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Entry Data

Table mix-ins: ['Structure'] Extra columns: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1021446
  • Created at: Sept. 4, 2022, 3:28 p.m.
  • Last updated at: Sept. 4, 2022, 3:28 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['F', 'O', 'Th']
  • Chemical System: F-O-Th
  • Density: 9.300714315075712
  • Atomic Density: 0.07832657464188195
  • Unit Cell Volume: 102.13647202851541
  • Molar Volume: 7.688502641069032
  • Full Formula: Th2 O2 F4
  • Reduced Formula: ThOF2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm