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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102630
  • 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: 5
  • Number of elements: 3
  • Element list: ['Ba', 'Ga', 'H']
  • Chemical System: Ba-Ga-H
  • Density: 5.203017397575422
  • Atomic Density: 0.056195396236313644
  • Unit Cell Volume: 88.97526016141842
  • Molar Volume: 10.716430816993642
  • Full Formula: Ba1 Ga2 H2
  • Reduced Formula: Ba(GaH)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1