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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-102431
  • 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: 5
  • Number of elements: 3
  • Element list: ['Ca', 'Al', 'Sn']
  • Chemical System: Al-Ca-Sn
  • Density: 4.164115365151832
  • Atomic Density: 0.03782780332810849
  • Unit Cell Volume: 132.1779104282452
  • Molar Volume: 15.91987963923129
  • Full Formula: Ca1 Al2 Sn2
  • Reduced Formula: Ca(AlSn)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 164
  • Spacegroup Symbol: P-3m1
  • Crystal System: trigonal
  • Pointgroup: -3m1