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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-55622
  • 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: 24
  • Number of elements: 4
  • Element list: ['Sr', 'B', 'N', 'Cl']
  • Chemical System: B-Cl-N-Sr
  • Density: 3.4574867416531005
  • Atomic Density: 0.050068184041507764
  • Unit Cell Volume: 479.34632460612926
  • Molar Volume: 12.027879331528174
  • Full Formula: Sr8 B4 N8 Cl4
  • Reduced Formula: Sr2BN2Cl
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm