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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-101830
  • 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: 34
  • Number of elements: 4
  • Element list: ['H', 'C', 'S', 'N']
  • Chemical System: C-H-N-S
  • Density: 1.3754213229034546
  • Atomic Density: 0.0943689806354327
  • Unit Cell Volume: 360.2878803083524
  • Molar Volume: 6.381483321585089
  • Full Formula: H14 C16 S2 N2
  • Reduced Formula: H7C8SN
  • Formula Anonymous: ABC7D8
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1