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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-50819
  • 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: 26
  • Number of elements: 3
  • Element list: ['Hf', 'P', 'O']
  • Chemical System: Hf-O-P
  • Density: 5.468987527025046
  • Atomic Density: 0.0760593956118058
  • Unit Cell Volume: 341.83810942568584
  • Molar Volume: 7.917681584976012
  • Full Formula: Hf4 P4 O18
  • Reduced Formula: Hf2P2O9
  • Formula Anonymous: A2B2C9
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm