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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-23377
  • 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: 12
  • Number of elements: 3
  • Element list: ['Zr', 'Mn', 'P']
  • Chemical System: Mn-P-Zr
  • Density: 6.811989837967162
  • Atomic Density: 0.06947679698792537
  • Unit Cell Volume: 172.71953400623124
  • Molar Volume: 8.667844548226094
  • Full Formula: Zr4 Mn4 P4
  • Reduced Formula: ZrMnP
  • Formula Anonymous: ABC
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm