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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-24834
  • 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: 52
  • Number of elements: 3
  • Element list: ['Si', 'P', 'H']
  • Chemical System: H-P-Si
  • Density: 1.15077598928981
  • Atomic Density: 0.07247828385727682
  • Unit Cell Volume: 717.4562811448135
  • Molar Volume: 8.308889835000386
  • Full Formula: Si12 P4 H36
  • Reduced Formula: Si3PH9
  • Formula Anonymous: AB3C9
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m