Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

Entry Data

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

Base Information:

  • Database Entry ID: jvasp-57881
  • 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: 10
  • Number of elements: 2
  • Element list: ['Hf', 'Al']
  • Chemical System: Al-Hf
  • Density: 7.961802318571238
  • Atomic Density: 0.05474354780754922
  • Unit Cell Volume: 182.66992916050984
  • Molar Volume: 11.000640260238189
  • Full Formula: Hf4 Al6
  • Reduced Formula: Hf2Al3
  • Formula Anonymous: A2B3
  • Spacegroup Number: 43
  • Spacegroup Symbol: Fdd2
  • Crystal System: orthorhombic
  • Pointgroup: mm2