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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-8172
  • 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: 6
  • Number of elements: 3
  • Element list: ['Li', 'Nd', 'As']
  • Chemical System: As-Li-Nd
  • Density: 4.730925057153978
  • Atomic Density: 0.054283051306453
  • Unit Cell Volume: 110.53173791073787
  • Molar Volume: 11.093961402431532
  • Full Formula: Li3 Nd1 As2
  • Reduced Formula: Li3NdAs2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1