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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-39179
  • 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: 5
  • Number of elements: 3
  • Element list: ['Sc', 'As', 'O']
  • Chemical System: As-O-Sc
  • Density: 4.6191569956694005
  • Atomic Density: 0.08285061995767702
  • Unit Cell Volume: 60.34957858558179
  • Molar Volume: 7.268673140981104
  • Full Formula: Sc1 As1 O3
  • Reduced Formula: ScAsO3
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m