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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-29499
  • 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: 10
  • Number of elements: 4
  • Element list: ['Cd', 'Bi', 'S', 'Br']
  • Chemical System: Bi-Br-Cd-S
  • Density: 6.089027762142555
  • Atomic Density: 0.03939297499431948
  • Unit Cell Volume: 253.8523683840079
  • Molar Volume: 15.287346946678692
  • Full Formula: Cd2 Bi2 S4 Br2
  • Reduced Formula: CdBiS2Br
  • Formula Anonymous: ABCD2
  • Spacegroup Number: 12
  • Spacegroup Symbol: C12/m1
  • Crystal System: monoclinic
  • Pointgroup: 2/m