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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-348387
  • Created at: Sept. 4, 2022, 2:51 p.m.
  • Last updated at: Sept. 4, 2022, 2:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['C', 'H']
  • Chemical System: C-H
  • Density: 1.5819753448663973
  • Atomic Density: 0.2534667740354138
  • Unit Cell Volume: 15.781161121501192
  • Molar Volume: 2.375909340747991
  • Full Formula: H3 C1
  • Reduced Formula: H3C
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m