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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119296
  • 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: 28
  • Number of elements: 3
  • Element list: ['Mo', 'P', 'O']
  • Chemical System: Mo-O-P
  • Density: 4.023149471389054
  • Atomic Density: 0.08196567705124012
  • Unit Cell Volume: 341.6064016953834
  • Molar Volume: 7.347149412595362
  • Full Formula: Mo4 P4 O20
  • Reduced Formula: MoPO5
  • Formula Anonymous: ABC5
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm