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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-34692
  • 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: 28
  • Number of elements: 2
  • Element list: ['As', 'S']
  • Chemical System: As-S
  • Density: 3.5758846274691463
  • Atomic Density: 0.03807740500793129
  • Unit Cell Volume: 735.3442282678604
  • Molar Volume: 15.815523034580812
  • Full Formula: As16 S12
  • Reduced Formula: As4S3
  • Formula Anonymous: A3B4
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm