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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-17266
  • 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: ['Sc', 'Si', 'Pt']
  • Chemical System: Pt-Sc-Si
  • Density: 11.86678286107016
  • Atomic Density: 0.0617115584710237
  • Unit Cell Volume: 129.63535840301867
  • Molar Volume: 9.75852969720034
  • Full Formula: Sc2 Si2 Pt4
  • Reduced Formula: ScSiPt2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm