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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111903
  • 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: ['Fe', 'Mo', 'Cl', 'O']
  • Chemical System: Cl-Fe-Mo-O
  • Density: 3.9674879465048694
  • Atomic Density: 0.06657073925828487
  • Unit Cell Volume: 210.30260676063727
  • Molar Volume: 9.04622785791061
  • Full Formula: Fe2 Mo2 Cl2 O8
  • Reduced Formula: FeMoClO4
  • Formula Anonymous: ABCD4
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm