Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97533
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 24
  • Number of elements: 4
  • Element list: ['H', 'Se', 'N', 'O']
  • Chemical System: H-N-O-Se
  • Density: 2.6145688579897963
  • Atomic Density: 0.07923152028117338
  • Unit Cell Volume: 302.9097499938136
  • Molar Volume: 7.600688133496477
  • Full Formula: H6 Se3 N3 O12
  • Reduced Formula: H2SeNO4
  • Formula Anonymous: ABC2D4
  • Spacegroup Number: 5
  • Spacegroup Symbol: C121
  • Crystal System: monoclinic
  • Pointgroup: 2