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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100380
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['La', 'Cu', 'Ni']
  • Chemical System: Cu-La-Ni
  • Density: 8.188868023655429
  • Atomic Density: 0.06693102040719413
  • Unit Cell Volume: 89.6445319897601
  • Molar Volume: 8.997533166777638
  • Full Formula: La1 Cu2 Ni3
  • Reduced Formula: LaCu2Ni3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm