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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215838

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-1215838
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 38
  • Number of elements: 3
  • Element list: ['Zn', 'B', 'Rh']
  • Chemical System: B-Rh-Zn
  • Density: 9.57037061450428
  • Atomic Density: 0.07834659907435333
  • Unit Cell Volume: 485.0242441785741
  • Molar Volume: 7.6865375538315375
  • Full Formula: Zn15 B6 Rh17
  • Reduced Formula: Zn15B6Rh17
  • Formula Anonymous: A6B15C17
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -200.44949931
  • Final energy per atom: -5.274986823947368
  • 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.