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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-11683
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 4
  • Element list: ['K', 'Sc', 'Mo', 'O']
  • Chemical System: K-Mo-O-Sc
  • Density: 3.216953924226278
  • Atomic Density: 0.057553469832951586
  • Unit Cell Volume: 208.50176426946783
  • Molar Volume: 10.463558109492283
  • Full Formula: K1 Sc1 Mo2 O8
  • Reduced Formula: KSc(MoO4)2
  • Formula Anonymous: ABC2D8
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1