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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-37998
  • 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: 13
  • Number of elements: 4
  • Element list: ['Li', 'P', 'S', 'I']
  • Chemical System: I-Li-P-S
  • Density: 2.2323328850740527
  • Atomic Density: 0.048566033122060925
  • Unit Cell Volume: 267.6767931061432
  • Molar Volume: 12.399902509773785
  • Full Formula: Li6 P1 S5 I1
  • Reduced Formula: Li6PS5I
  • Formula Anonymous: ABC5D6
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m