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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96764
  • 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: 42
  • Number of elements: 3
  • Element list: ['S', 'N', 'O']
  • Chemical System: N-O-S
  • Density: 2.2326219344837366
  • Atomic Density: 0.0646860583227923
  • Unit Cell Volume: 649.2898329098094
  • Molar Volume: 9.309797066237506
  • Full Formula: S14 N12 O16
  • Reduced Formula: S7(N3O4)2
  • Formula Anonymous: A6B7C8
  • Spacegroup Number: 113
  • Spacegroup Symbol: P-42_1m
  • Crystal System: tetragonal
  • Pointgroup: -42m