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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-10256
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Na', 'Al', 'As']
  • Chemical System: Al-As-Na
  • Density: 2.79901221661373
  • Atomic Density: 0.04114675470957086
  • Unit Cell Volume: 291.63903896432356
  • Molar Volume: 14.635761197952341
  • Full Formula: Na6 Al2 As4
  • Reduced Formula: Na3AlAs2
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 72
  • Spacegroup Symbol: Ibam
  • Crystal System: orthorhombic
  • Pointgroup: mmm