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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102144
  • 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: 9
  • Number of elements: 3
  • Element list: ['Th', 'Al', 'Co']
  • Chemical System: Al-Co-Th
  • Density: 9.133370782270458
  • Atomic Density: 0.05189680253507137
  • Unit Cell Volume: 173.42108878322293
  • Molar Volume: 11.604068971166951
  • Full Formula: Th3 Al3 Co3
  • Reduced Formula: ThAlCo
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m