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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-35665
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 5
  • Number of elements: 3
  • Element list: ['Mg', 'Ni', 'H']
  • Chemical System: H-Mg-Ni
  • Density: 3.819793613539792
  • Atomic Density: 0.13370577289702085
  • Unit Cell Volume: 37.395543151685466
  • Molar Volume: 4.504024493122078
  • Full Formula: Mg1 Ni1 H3
  • Reduced Formula: MgNiH3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m