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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-116780
  • 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: 18
  • Number of elements: 3
  • Element list: ['Ca', 'Mn', 'O']
  • Chemical System: Ca-Mn-O
  • Density: 4.286538232035518
  • Atomic Density: 0.0860378522692656
  • Unit Cell Volume: 209.21024322721215
  • Molar Volume: 6.999408517489491
  • Full Formula: Ca4 Mn4 O10
  • Reduced Formula: Ca2Mn2O5
  • Formula Anonymous: A2B2C5
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm