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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-60865
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 28
  • Number of elements: 3
  • Element list: ['Hf', 'Mo', 'As']
  • Chemical System: As-Hf-Mo
  • Density: 12.219370576932128
  • Atomic Density: 0.04988712243739929
  • Unit Cell Volume: 561.267089219983
  • Molar Volume: 12.071533625850773
  • Full Formula: Hf18 Mo8 As2
  • Reduced Formula: Hf9Mo4As
  • Formula Anonymous: AB4C9
  • Spacegroup Number: 194
  • Spacegroup Symbol: P6_3/mmc
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm