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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-36525
  • 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: 8
  • Number of elements: 3
  • Element list: ['Ti', 'Zn', 'N']
  • Chemical System: N-Ti-Zn
  • Density: 5.680074254018831
  • Atomic Density: 0.07811879026175741
  • Unit Cell Volume: 102.40813987510444
  • Molar Volume: 7.708952916220596
  • Full Formula: Ti4 Zn2 N2
  • Reduced Formula: Ti2ZnN
  • Formula Anonymous: ABC2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm