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-1741715
  • Created at: Sept. 4, 2022, 4:03 p.m.
  • Last updated at: Sept. 4, 2022, 4:03 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Mn', 'N', 'S']
  • Chemical System: Mn-N-S
  • Density: 5.621714190184234
  • Atomic Density: 0.09959946976828431
  • Unit Cell Volume: 100.40214092770526
  • Molar Volume: 6.046358252719981
  • Full Formula: Mn4 S2 N4
  • Reduced Formula: Mn2SN2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm