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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119475
  • 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: 12
  • Number of elements: 3
  • Element list: ['Zr', 'Mn', 'Si']
  • Chemical System: Mn-Si-Zr
  • Density: 7.62063761600466
  • Atomic Density: 0.07429366850800667
  • Unit Cell Volume: 161.52116648684205
  • Molar Volume: 8.105860002526311
  • Full Formula: Zr3 Mn8 Si1
  • Reduced Formula: Zr3Mn8Si
  • Formula Anonymous: AB3C8
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1