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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-12091
  • 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: 22
  • Number of elements: 3
  • Element list: ['Au', 'Se', 'O']
  • Chemical System: Au-O-Se
  • Density: 6.7778020405702595
  • Atomic Density: 0.06763370877068157
  • Unit Cell Volume: 325.28158517216707
  • Molar Volume: 8.904052238830541
  • Full Formula: Au4 Se4 O14
  • Reduced Formula: Au2Se2O7
  • Formula Anonymous: A2B2C7
  • Spacegroup Number: 32
  • Spacegroup Symbol: Pba2
  • Crystal System: orthorhombic
  • Pointgroup: mm2