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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-36474
  • 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: 5
  • Number of elements: 3
  • Element list: ['Ca', 'Bi', 'P']
  • Chemical System: Bi-Ca-P
  • Density: 3.8069777258841486
  • Atomic Density: 0.03182524880340435
  • Unit Cell Volume: 157.1079626395615
  • Molar Volume: 18.92252531064521
  • Full Formula: Ca3 Bi1 P1
  • Reduced Formula: Ca3BiP
  • Formula Anonymous: ABC3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m