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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-111859
  • 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: 14
  • Number of elements: 4
  • Element list: ['Lu', 'Mg', 'Ti', 'S']
  • Chemical System: Lu-Mg-S-Ti
  • Density: 4.631135786295927
  • Atomic Density: 0.044475659166257855
  • Unit Cell Volume: 314.7789209298851
  • Molar Volume: 13.540306929433417
  • Full Formula: Lu3 Mg2 Ti1 S8
  • Reduced Formula: Lu3Mg2TiS8
  • Formula Anonymous: AB2C3D8
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m