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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-95265
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 38
  • Number of elements: 4
  • Element list: ['Fe', 'P', 'H', 'O']
  • Chemical System: Fe-H-O-P
  • Density: 2.4436279346750505
  • Atomic Density: 0.09357214809277827
  • Unit Cell Volume: 406.1037474775336
  • Molar Volume: 6.435826132824216
  • Full Formula: Fe2 P6 H12 O18
  • Reduced Formula: FeP3(H2O3)3
  • Formula Anonymous: AB3C6D9
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m