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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-42093
  • 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: 10
  • Number of elements: 2
  • Element list: ['Pa', 'S']
  • Chemical System: Pa-S
  • Density: 7.384845517811796
  • Atomic Density: 0.039830939616113364
  • Unit Cell Volume: 251.06111220018926
  • Molar Volume: 15.11925357031693
  • Full Formula: Pa4 S6
  • Reduced Formula: Pa2S3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 167
  • Spacegroup Symbol: R-3cH
  • Crystal System: trigonal
  • Pointgroup: -3m