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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-119102
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['Ga', 'Cu', 'Se']
  • Chemical System: Cu-Ga-Se
  • Density: 5.093428272837436
  • Atomic Density: 0.04113909956480641
  • Unit Cell Volume: 340.308858193306
  • Molar Volume: 14.63848461367834
  • Full Formula: Ga5 Cu1 Se8
  • Reduced Formula: Ga5CuSe8
  • Formula Anonymous: AB5C8
  • Spacegroup Number: 111
  • Spacegroup Symbol: P-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m