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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-40641
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['Sm', 'Mn', 'Al', 'S']
  • Chemical System: Al-Mn-S-Sm
  • Density: 5.061073284734705
  • Atomic Density: 0.048285660507364575
  • Unit Cell Volume: 497.0419737002354
  • Molar Volume: 12.471903038545983
  • Full Formula: Sm6 Mn2 Al2 S14
  • Reduced Formula: Sm3MnAlS7
  • Formula Anonymous: ABC3D7
  • Spacegroup Number: 173
  • Spacegroup Symbol: P6_3
  • Crystal System: hexagonal
  • Pointgroup: 6