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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-32451
  • 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: 18
  • Number of elements: 4
  • Element list: ['H', 'C', 'N', 'O']
  • Chemical System: C-H-N-O
  • Density: 1.3394715419307774
  • Atomic Density: 0.11513335873531408
  • Unit Cell Volume: 156.34044031826704
  • Molar Volume: 5.23057854487213
  • Full Formula: H10 C2 N2 O4
  • Reduced Formula: H5CNO2
  • Formula Anonymous: ABC2D5
  • Spacegroup Number: 7
  • Spacegroup Symbol: P1c1
  • Crystal System: monoclinic
  • Pointgroup: m