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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-100622
  • 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: ['Ti', 'Mn', 'As']
  • Chemical System: As-Mn-Ti
  • Density: 7.07455689332535
  • Atomic Density: 0.07191489622890802
  • Unit Cell Volume: 125.14792444881844
  • Molar Volume: 8.373982409473667
  • Full Formula: Ti3 Mn3 As3
  • Reduced Formula: TiMnAs
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m