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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-122054
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['Li', 'H', 'N']
  • Chemical System: H-Li-N
  • Density: 1.2270247962846186
  • Atomic Density: 0.1287136594867157
  • Unit Cell Volume: 124.30693108878106
  • Molar Volume: 4.678711477876623
  • Full Formula: Li4 H8 N4
  • Reduced Formula: LiH2N
  • Formula Anonymous: ABC2
  • Spacegroup Number: 33
  • Spacegroup Symbol: Pna2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2