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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-76915
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Sc', 'Ni', 'Pd']
  • Chemical System: Ni-Pd-Sc
  • Density: 0.45823261763146134
  • Atomic Density: 0.004328264133046787
  • Unit Cell Volume: 924.1580174046096
  • Molar Volume: 139.13524163232722
  • Full Formula: Sc2 Ni1 Pd1
  • Reduced Formula: Sc2NiPd
  • Formula Anonymous: ABC2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm