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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96805
  • 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: 22
  • Number of elements: 4
  • Element list: ['La', 'S', 'N', 'Cl']
  • Chemical System: Cl-La-N-S
  • Density: 4.7537726496458195
  • Atomic Density: 0.04078138728771675
  • Unit Cell Volume: 539.461785465703
  • Molar Volume: 14.766885485069935
  • Full Formula: La8 S6 N2 Cl6
  • Reduced Formula: La4S3NCl3
  • Formula Anonymous: AB3C3D4
  • Spacegroup Number: 186
  • Spacegroup Symbol: P6_3mc
  • Crystal System: hexagonal
  • Pointgroup: 6mm