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Entry Data

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

Base Information:

  • Database Entry ID: jvasp-97739
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 22
  • Number of elements: 3
  • Element list: ['Sm', 'P', 'Pt']
  • Chemical System: P-Pt-Sm
  • Density: 13.164501528917663
  • Atomic Density: 0.05575334348880412
  • Unit Cell Volume: 394.59516906672764
  • Molar Volume: 10.801398415162872
  • Full Formula: Sm4 P6 Pt12
  • Reduced Formula: Sm2(PPt2)3
  • Formula Anonymous: A2B3C6
  • Spacegroup Number: 141
  • Spacegroup Symbol: I4_1/amd
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm