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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-14995
  • 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: 7
  • Number of elements: 2
  • Element list: ['Ti', 'Cu']
  • Chemical System: Cu-Ti
  • Density: 6.730041545086221
  • Atomic Density: 0.07132114147947814
  • Unit Cell Volume: 98.14761590732772
  • Molar Volume: 8.443696546462037
  • Full Formula: Ti3 Cu4
  • Reduced Formula: Ti3Cu4
  • Formula Anonymous: A3B4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm