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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-25772
  • 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: 16
  • Number of elements: 4
  • Element list: ['Na', 'Ca', 'C', 'O']
  • Chemical System: C-Ca-Na-O
  • Density: 2.6071437433520326
  • Atomic Density: 0.08205106773867868
  • Unit Cell Volume: 195.00050932862678
  • Molar Volume: 7.339503221554272
  • Full Formula: Na2 Ca2 C3 O9
  • Reduced Formula: Na2Ca2(CO3)3
  • Formula Anonymous: A2B2C3D9
  • Spacegroup Number: 38
  • Spacegroup Symbol: Amm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2