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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-13094
  • 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: 11
  • Number of elements: 3
  • Element list: ['Mg', 'H', 'O']
  • Chemical System: H-Mg-O
  • Density: 3.084587610437404
  • Atomic Density: 0.114004767771003
  • Unit Cell Volume: 96.48719272947669
  • Molar Volume: 5.28235869231052
  • Full Formula: Mg4 H2 O5
  • Reduced Formula: Mg4H2O5
  • Formula Anonymous: A2B4C5
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1