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Entry Data

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

Base Information:

  • Database Entry ID: oqmd-345758
  • Created at: Sept. 4, 2022, 2:51 p.m.
  • Last updated at: Sept. 4, 2022, 2:51 p.m.
  • Input Source: OQMD

Structure:

  • Number of sites: 4
  • Number of elements: 2
  • Element list: ['Cl', 'N']
  • Chemical System: Cl-N
  • Density: 3.387412822967035
  • Atomic Density: 0.10532418007894905
  • Unit Cell Volume: 37.977983754553556
  • Molar Volume: 5.7177190987728705
  • Full Formula: N3 Cl1
  • Reduced Formula: N3Cl
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m