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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-52797
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Li', 'Mo', 'O']
  • Chemical System: Li-Mo-O
  • Density: 4.827847877594626
  • Atomic Density: 0.1105333011748411
  • Unit Cell Volume: 108.56456717074298
  • Molar Volume: 5.4482592087557435
  • Full Formula: Li4 Mo2 O6
  • Reduced Formula: Li2MoO3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1