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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-108750
  • 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: 4
  • Number of elements: 3
  • Element list: ['Mo', 'Cl', 'O']
  • Chemical System: Cl-Mo-O
  • Density: 4.001824963014109
  • Atomic Density: 0.0527211583829422
  • Unit Cell Volume: 75.87086708045834
  • Molar Volume: 11.42262602854426
  • Full Formula: Mo1 Cl2 O1
  • Reduced Formula: MoCl2O
  • Formula Anonymous: ABC2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm