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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-1735571
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 20
  • Number of elements: 4
  • Element list: ['Cl', 'Fe', 'Mo', 'O']
  • Chemical System: Cl-Fe-Mo-O
  • Density: 2.4721241304159927
  • Atomic Density: 0.03579104753707369
  • Unit Cell Volume: 558.7989560597035
  • Molar Volume: 16.82582984966295
  • Full Formula: Fe2 Mo2 Cl14 O2
  • Reduced Formula: FeMoCl7O
  • Formula Anonymous: ABCD7
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1