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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-6071
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Sept. 4, 2022, 2:48 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Np', 'O', 'S']
  • Chemical System: Np-O-S
  • Density: 9.441000535437087
  • Atomic Density: 0.059833884019841195
  • Unit Cell Volume: 100.27762860940754
  • Molar Volume: 10.064766576080922
  • Full Formula: Np2 S2 O2
  • Reduced Formula: NpSO
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm