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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116572
  • 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: 30
  • Number of elements: 4
  • Element list: ['As', 'H', 'C', 'O']
  • Chemical System: As-C-H-O
  • Density: 2.745283308933335
  • Atomic Density: 0.09397088805347467
  • Unit Cell Volume: 319.2478077138989
  • Molar Volume: 6.408517451248376
  • Full Formula: As4 H12 C2 O12
  • Reduced Formula: As2H6CO6
  • Formula Anonymous: AB2C6D6
  • Spacegroup Number: 41
  • Spacegroup Symbol: Aea2
  • Crystal System: orthorhombic
  • Pointgroup: mm2