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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116133
  • 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: 4
  • Number of elements: 3
  • Element list: ['Li', 'P', 'H']
  • Chemical System: H-Li-P
  • Density: 1.4526486144669697
  • Atomic Density: 0.08763249470581719
  • Unit Cell Volume: 45.6451686492325
  • Molar Volume: 6.87204076549043
  • Full Formula: Li1 P1 H2
  • Reduced Formula: LiPH2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm