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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96827
  • 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: 26
  • Number of elements: 5
  • Element list: ['Sr', 'Ni', 'Se', 'Cl', 'O']
  • Chemical System: Cl-Ni-O-Se-Sr
  • Density: 4.404801784102171
  • Atomic Density: 0.06171611513438992
  • Unit Cell Volume: 421.283808019732
  • Molar Volume: 9.75780919924478
  • Full Formula: Sr4 Ni2 Se4 Cl4 O12
  • Reduced Formula: Sr2NiSe2(ClO3)2
  • Formula Anonymous: AB2C2D2E6
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m