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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-56321
  • 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: 10
  • Number of elements: 3
  • Element list: ['Rb', 'Ti', 'Br']
  • Chemical System: Br-Rb-Ti
  • Density: 4.242982919525485
  • Atomic Density: 0.03424749976743989
  • Unit Cell Volume: 291.99211819565573
  • Molar Volume: 17.58417636584796
  • Full Formula: Rb2 Ti2 Br6
  • Reduced Formula: RbTiBr3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm