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  1. Third-Parties
  2. MatprojStructure
  3. mp-1199795

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-1199795
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 252
  • Number of elements: 5
  • Element list: ['B', 'P', 'H', 'Rh', 'C']
  • Chemical System: B-C-H-P-Rh
  • Density: 1.1483339593405426
  • Atomic Density: 0.0975116322124056
  • Unit Cell Volume: 2584.3070645261964
  • Molar Volume: 6.1758178212853805
  • Full Formula: B32 P8 H156 Rh4 C52
  • Reduced Formula: B8P2H39RhC13
  • Formula Anonymous: AB2C8D13E39
  • Spacegroup Number: 14
  • Spacegroup Symbol: P12_1/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m

Thermodynamics:

  • Final energy: -1336.83883137
  • Final energy per atom: -5.3049159975
  • 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.