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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-99948
  • 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: 7
  • Number of elements: 3
  • Element list: ['Nb', 'Cu', 'Se']
  • Chemical System: Cu-Nb-Se
  • Density: 6.433024406762367
  • Atomic Density: 0.047980298032498286
  • Unit Cell Volume: 145.8932163209724
  • Molar Volume: 12.551278351628932
  • Full Formula: Nb2 Cu1 Se4
  • Reduced Formula: Nb2CuSe4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 156
  • Spacegroup Symbol: P3m1
  • Crystal System: trigonal
  • Pointgroup: 3m1