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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14202
  • 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: ['U', 'Fe', 'S']
  • Chemical System: Fe-S-U
  • Density: 7.579999415522743
  • Atomic Density: 0.0585125118748513
  • Unit Cell Volume: 170.90361838145603
  • Molar Volume: 10.292056462864517
  • Full Formula: U2 Fe2 S6
  • Reduced Formula: UFeS3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm