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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-85099
  • 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: 4
  • Number of elements: 3
  • Element list: ['Ca', 'Tl', 'Sn']
  • Chemical System: Ca-Sn-Tl
  • Density: 0.42584790595483996
  • Atomic Density: 0.0025438516896595037
  • Unit Cell Volume: 1572.4187130325206
  • Molar Volume: 236.73317058849713
  • Full Formula: Ca2 Tl1 Sn1
  • Reduced Formula: Ca2TlSn
  • Formula Anonymous: ABC2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm