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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104150
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 22
  • Number of elements: 3
  • Element list: ['H', 'C', 'N']
  • Chemical System: C-H-N
  • Density: 1.2157640838165182
  • Atomic Density: 0.1410585891439443
  • Unit Cell Volume: 155.96356190369897
  • Molar Volume: 4.269247832795677
  • Full Formula: H14 C6 N2
  • Reduced Formula: H7C3N
  • Formula Anonymous: AB3C7
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m