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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-107078
  • 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: 10
  • Number of elements: 4
  • Element list: ['Ca', 'Cd', 'C', 'O']
  • Chemical System: C-Ca-Cd-O
  • Density: 3.767164078736551
  • Atomic Density: 0.0832507385357252
  • Unit Cell Volume: 120.11905450795156
  • Molar Volume: 7.233738542049968
  • Full Formula: Ca1 Cd1 C2 O6
  • Reduced Formula: CaCd(CO3)2
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3