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  1. Third-Parties
  2. MatprojStructure
  3. mp-1216186

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1216186
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 21
  • Number of elements: 3
  • Element list: ['Y', 'As', 'Rh']
  • Chemical System: As-Rh-Y
  • Density: 9.459352383262436
  • Atomic Density: 0.061755135808092734
  • Unit Cell Volume: 340.0526891440832
  • Molar Volume: 9.751643618296159
  • Full Formula: Y2 As7 Rh12
  • Reduced Formula: Y2As7Rh12
  • Formula Anonymous: A2B7C12
  • Spacegroup Number: 143
  • Spacegroup Symbol: P3
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -148.42571434
  • Final energy per atom: -7.06789115904762
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.