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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-91496
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 4
  • Element list: ['Nb', 'Tl', 'P', 'S']
  • Chemical System: Nb-P-S-Tl
  • Density: 3.7715176419305374
  • Atomic Density: 0.04286439002290391
  • Unit Cell Volume: 653.2228729964113
  • Molar Volume: 14.049286031557115
  • Full Formula: Nb4 Tl2 P2 S20
  • Reduced Formula: Nb2TlPS10
  • Formula Anonymous: ABC2D10
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m