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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99359
  • 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: 44
  • Number of elements: 3
  • Element list: ['P', 'S', 'N']
  • Chemical System: N-P-S
  • Density: 1.8073113337257065
  • Atomic Density: 0.06331216797818306
  • Unit Cell Volume: 694.9690937003152
  • Molar Volume: 9.511822059347562
  • Full Formula: P4 S4 N36
  • Reduced Formula: PSN9
  • Formula Anonymous: ABC9
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m