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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104651
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Pr', 'Lu', 'S']
  • Chemical System: Lu-Pr-S
  • Density: 5.686951753756588
  • Atomic Density: 0.04155562532727936
  • Unit Cell Volume: 240.6413071935043
  • Molar Volume: 14.491758245896834
  • Full Formula: Pr2 Lu2 S6
  • Reduced Formula: PrLuS3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm