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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-10002
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 22
  • Number of elements: 3
  • Element list: ['Nd', 'O', 'Ta']
  • Chemical System: Nd-O-Ta
  • Density: 7.923212291709462
  • Atomic Density: 0.07232790776015104
  • Unit Cell Volume: 304.17028061913425
  • Molar Volume: 8.326164749532394
  • Full Formula: Nd6 Ta2 O14
  • Reduced Formula: Nd3TaO7
  • Formula Anonymous: AB3C7
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm