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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-3138
  • 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: 5
  • Number of elements: 3
  • Element list: ['Nd', 'Te', 'S']
  • Chemical System: Nd-S-Te
  • Density: 5.500754591270704
  • Atomic Density: 0.03449120438626966
  • Unit Cell Volume: 144.96449425205958
  • Molar Volume: 17.459931791762276
  • Full Formula: Nd2 Te1 S2
  • Reduced Formula: Nd2TeS2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1