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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-30126
  • 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: 16
  • Number of elements: 2
  • Element list: ['Mo', 'O']
  • Chemical System: Mo-O
  • Density: 4.471211780915124
  • Atomic Density: 0.07482729872055174
  • Unit Cell Volume: 213.82570630744297
  • Molar Volume: 8.048053134311509
  • Full Formula: Mo4 O12
  • Reduced Formula: MoO3
  • Formula Anonymous: AB3
  • Spacegroup Number: 33
  • Spacegroup Symbol: Pna2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2