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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52910
  • 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: 4
  • Element list: ['Mg', 'H', 'Se', 'O']
  • Chemical System: H-Mg-O-Se
  • Density: 3.5154553193937694
  • Atomic Density: 0.08309966273514983
  • Unit Cell Volume: 264.74235003957904
  • Molar Volume: 7.2468895321433475
  • Full Formula: Mg2 H4 Se4 O12
  • Reduced Formula: MgH2(SeO3)2
  • Formula Anonymous: AB2C2D6
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m