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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-103138
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ca', 'Re', 'N']
  • Chemical System: Ca-N-Re
  • Density: 9.123097484242852
  • Atomic Density: 0.08641906867884129
  • Unit Cell Volume: 46.28608085172936
  • Molar Volume: 6.968532352946373
  • Full Formula: Ca1 Re1 N2
  • Reduced Formula: CaReN2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m