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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-11203
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 16
  • Number of elements: 3
  • Element list: ['K', 'P', 'Au']
  • Chemical System: Au-K-P
  • Density: 2.9444489740373387
  • Atomic Density: 0.031217725242071483
  • Unit Cell Volume: 512.5293363283604
  • Molar Volume: 19.290773793742297
  • Full Formula: K10 P4 Au2
  • Reduced Formula: K5P2Au
  • Formula Anonymous: AB2C5
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm