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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97777
  • 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: 56
  • Number of elements: 4
  • Element list: ['Na', 'Nd', 'Ga', 'S']
  • Chemical System: Ga-Na-Nd-S
  • Density: 3.7244391569180846
  • Atomic Density: 0.04468941016875565
  • Unit Cell Volume: 1253.0932896302152
  • Molar Volume: 13.475543170651079
  • Full Formula: Na4 Nd4 Ga16 S32
  • Reduced Formula: NaNd(GaS2)4
  • Formula Anonymous: ABC4D8
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm