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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-15315
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Mg', 'Cu', 'As']
  • Chemical System: As-Cu-Mg
  • Density: 5.337200644108667
  • Atomic Density: 0.05923854546949381
  • Unit Cell Volume: 101.28540382696993
  • Molar Volume: 10.165915979657594
  • Full Formula: Mg2 Cu2 As2
  • Reduced Formula: MgCuAs
  • Formula Anonymous: ABC
  • Spacegroup Number: 129
  • Spacegroup Symbol: P4/nmm1
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm