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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-22722
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 2
  • Element list: ['Mo', 'Br']
  • Chemical System: Br-Mo
  • Density: 4.977445347388265
  • Atomic Density: 0.035721373943891785
  • Unit Cell Volume: 447.9111028912688
  • Molar Volume: 16.8586481848629
  • Full Formula: Mo4 Br12
  • Reduced Formula: MoBr3
  • Formula Anonymous: AB3
  • Spacegroup Number: 59
  • Spacegroup Symbol: Pmmn1
  • Crystal System: orthorhombic
  • Pointgroup: mmm