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: ['formation_energy']

Base Information:

  • Database Entry ID: oqmd-1557767
  • Created at: Sept. 4, 2022, 3:55 p.m.
  • Last updated at: Sept. 4, 2022, 3:55 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 14
  • Number of elements: 6
  • Element list: ['Er', 'Gd', 'N', 'O', 'S', 'Se']
  • Chemical System: Er-Gd-N-O-S-Se
  • Density: 7.356863216026919
  • Atomic Density: 0.049796626661219645
  • Unit Cell Volume: 281.1435420163279
  • Molar Volume: 12.093471312766434
  • Full Formula: Gd4 Er2 Se2 S2 N2 O2
  • Reduced Formula: Gd2ErSeSNO
  • Formula Anonymous: ABCDEF2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m