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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52301
  • 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: 21
  • Number of elements: 3
  • Element list: ['Nb', 'Tl', 'O']
  • Chemical System: Nb-O-Tl
  • Density: 7.4223877723126055
  • Atomic Density: 0.06718472067913331
  • Unit Cell Volume: 312.57106954859046
  • Molar Volume: 8.963557039644577
  • Full Formula: Nb4 Tl4 O13
  • Reduced Formula: Nb4Tl4O13
  • Formula Anonymous: A4B4C13
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m