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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-1029
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 1
  • Element list: ['Ti']
  • Chemical System: Ti
  • Density: 4.722608576696943
  • Atomic Density: 0.059415074295611964
  • Unit Cell Volume: 50.49223678613765
  • Molar Volume: 10.135711907112366
  • Full Formula: Ti3
  • Reduced Formula: Ti
  • Formula Anonymous: A
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm