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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52226
  • 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: 24
  • Number of elements: 4
  • Element list: ['K', 'I', 'O', 'F']
  • Chemical System: F-I-K-O
  • Density: 3.799509148129758
  • Atomic Density: 0.05817288898141506
  • Unit Cell Volume: 412.56331635287125
  • Molar Volume: 10.352143181205838
  • Full Formula: K4 I4 O8 F8
  • Reduced Formula: KI(OF)2
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 29
  • Spacegroup Symbol: Pca2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2