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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-96761
  • 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: 40
  • Number of elements: 3
  • Element list: ['P', 'Au', 'Cl']
  • Chemical System: Au-Cl-P
  • Density: 3.114719358112111
  • Atomic Density: 0.036666509512622944
  • Unit Cell Volume: 1090.9137665866301
  • Molar Volume: 16.424090648516177
  • Full Formula: P4 Au4 Cl32
  • Reduced Formula: PAuCl8
  • Formula Anonymous: ABC8
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm