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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-45301
  • 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: 22
  • Number of elements: 3
  • Element list: ['Rb', 'Ti', 'F']
  • Chemical System: F-Rb-Ti
  • Density: 3.717639760765164
  • Atomic Density: 0.056321201874417345
  • Unit Cell Volume: 390.6166642014259
  • Molar Volume: 10.692493341012
  • Full Formula: Rb6 Ti2 F14
  • Reduced Formula: Rb3TiF7
  • Formula Anonymous: AB3C7
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm