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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-104693
  • 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: ['Sr', 'Ca', 'Cr', 'O']
  • Chemical System: Ca-Cr-O-Sr
  • Density: 4.963886520455705
  • Atomic Density: 0.0912250404904605
  • Unit Cell Volume: 109.6190250641293
  • Molar Volume: 6.601411989101546
  • Full Formula: Sr1 Ca1 Cr2 O6
  • Reduced Formula: SrCaCr2O6
  • Formula Anonymous: ABC2D6
  • Spacegroup Number: 123
  • Spacegroup Symbol: P4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm