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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-36143
  • Created at: Sept. 4, 2022, 3:33 p.m.
  • Last updated at: Sept. 4, 2022, 3:33 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 56
  • Number of elements: 3
  • Element list: ['Al', 'Cl', 'Te']
  • Chemical System: Al-Cl-Te
  • Density: 3.0213126030345236
  • Atomic Density: 0.03003899278574181
  • Unit Cell Volume: 1864.2435982933737
  • Molar Volume: 20.04774528544927
  • Full Formula: Al8 Te16 Cl32
  • Reduced Formula: Al(TeCl2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 61
  • Spacegroup Symbol: Pbca
  • Crystal System: orthorhombic
  • Pointgroup: mmm