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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-109782
  • 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: 10
  • Number of elements: 3
  • Element list: ['Ca', 'Ga', 'Au']
  • Chemical System: Au-Ca-Ga
  • Density: 6.233896475917769
  • Atomic Density: 0.049061955320447104
  • Unit Cell Volume: 203.8239188529119
  • Molar Volume: 12.274563295870534
  • Full Formula: Ca2 Ga7 Au1
  • Reduced Formula: Ca2Ga7Au
  • Formula Anonymous: AB2C7
  • Spacegroup Number: 99
  • Spacegroup Symbol: P4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm