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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-98992
  • 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: 26
  • Number of elements: 3
  • Element list: ['Ca', 'Sn', 'As']
  • Chemical System: As-Ca-Sn
  • Density: 4.378781224485312
  • Atomic Density: 0.03863292923055732
  • Unit Cell Volume: 673.0009998681356
  • Molar Volume: 15.588102895487134
  • Full Formula: Ca10 Sn4 As12
  • Reduced Formula: Ca5(SnAs3)2
  • Formula Anonymous: A2B5C6
  • Spacegroup Number: 55
  • Spacegroup Symbol: Pbam
  • Crystal System: orthorhombic
  • Pointgroup: mmm