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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104021
  • 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: 76
  • Number of elements: 2
  • Element list: ['H', 'C']
  • Chemical System: C-H
  • Density: 1.1727759853238042
  • Atomic Density: 0.13198363362788804
  • Unit Cell Volume: 575.8289714486332
  • Molar Volume: 4.562793578618014
  • Full Formula: H46 C30
  • Reduced Formula: H23C15
  • Formula Anonymous: A15B23
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1