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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-94924
  • 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: 7
  • Number of elements: 4
  • Element list: ['Ce', 'Fe', 'Se', 'O']
  • Chemical System: Ce-Fe-O-Se
  • Density: 6.736064927071528
  • Atomic Density: 0.05398497824762046
  • Unit Cell Volume: 129.66570011183703
  • Molar Volume: 11.155215683106146
  • Full Formula: Ce2 Fe1 Se2 O2
  • Reduced Formula: Ce2Fe(SeO)2
  • Formula Anonymous: AB2C2D2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m