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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-21958
  • 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: 16
  • Number of elements: 3
  • Element list: ['Li', 'Ca', 'Ge']
  • Chemical System: Ca-Ge-Li
  • Density: 3.798970523165681
  • Atomic Density: 0.04758825629150582
  • Unit Cell Volume: 336.2174041845675
  • Molar Volume: 12.65467833725799
  • Full Formula: Li4 Ca4 Ge8
  • Reduced Formula: LiCaGe2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm