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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112335
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ca', 'Ga', 'H']
  • Chemical System: Ca-Ga-H
  • Density: 2.0786876137761268
  • Atomic Density: 0.07630312761406059
  • Unit Cell Volume: 183.47871755416983
  • Molar Volume: 7.892390454110668
  • Full Formula: Ca2 Ga2 H10
  • Reduced Formula: CaGaH5
  • Formula Anonymous: ABC5
  • Spacegroup Number: 4
  • Spacegroup Symbol: P12_11
  • Crystal System: monoclinic
  • Pointgroup: 2