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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-36261
  • 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: 3
  • Number of elements: 3
  • Element list: ['Mg', 'Ni', 'H']
  • Chemical System: H-Mg-Ni
  • Density: 4.496062316240393
  • Atomic Density: 0.09669241682290218
  • Unit Cell Volume: 31.02621796593083
  • Molar Volume: 6.228141728042545
  • Full Formula: Mg1 Ni1 H1
  • Reduced Formula: MgNiH
  • Formula Anonymous: ABC
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm