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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-112126
  • 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: 64
  • Number of elements: 2
  • Element list: ['H', 'C']
  • Chemical System: C-H
  • Density: 1.081490861114441
  • Atomic Density: 0.13596454170634384
  • Unit Cell Volume: 470.7109603489649
  • Molar Volume: 4.429199469525383
  • Full Formula: H42 C22
  • Reduced Formula: H21C11
  • Formula Anonymous: A11B21
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1