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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-110135
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['V', 'Fe', 'S']
  • Chemical System: Fe-S-V
  • Density: 4.419220354043038
  • Atomic Density: 0.06635715406492342
  • Unit Cell Volume: 150.69965161881512
  • Molar Volume: 9.075345145314666
  • Full Formula: V3 Fe1 S6
  • Reduced Formula: V3FeS6
  • Formula Anonymous: AB3C6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3