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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-105980
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Ti', 'Cu', 'Ni']
  • Chemical System: Cu-Ni-Ti
  • Density: 6.558827397556761
  • Atomic Density: 0.07248257231805535
  • Unit Cell Volume: 55.18567942715801
  • Molar Volume: 8.308398236164543
  • Full Formula: Ti2 Cu1 Ni1
  • Reduced Formula: Ti2CuNi
  • Formula Anonymous: ABC2
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2