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-32188
  • 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: 20
  • Number of elements: 4
  • Element list: ['H', 'I', 'N', 'O']
  • Chemical System: H-I-N-O
  • Density: 3.068907896010933
  • Atomic Density: 0.0884528977486563
  • Unit Cell Volume: 226.1090423157315
  • Molar Volume: 6.808302399670657
  • Full Formula: H8 I2 N2 O8
  • Reduced Formula: H4INO4
  • Formula Anonymous: ABC4D4
  • Spacegroup Number: 88
  • Spacegroup Symbol: I4_1/a
  • Crystal System: tetragonal
  • Pointgroup: 4/m