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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97540
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 42
  • Number of elements: 4
  • Element list: ['Zn', 'H', 'C', 'O']
  • Chemical System: C-H-O-Zn
  • Density: 2.1395309001801133
  • Atomic Density: 0.10844259438834176
  • Unit Cell Volume: 387.30168931217725
  • Molar Volume: 5.553298308627903
  • Full Formula: Zn2 H16 C8 O16
  • Reduced Formula: ZnH8(CO2)4
  • Formula Anonymous: AB4C8D8
  • Spacegroup Number: 15
  • Spacegroup Symbol: C12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m