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  1. Third-Parties
  2. MatprojStructure
  3. mp-13483

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-13483
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 12
  • Number of elements: 3
  • Element list: ['Pr', 'B', 'Pt']
  • Chemical System: B-Pr-Pt
  • Density: 15.20950711482408
  • Atomic Density: 0.0589625036047049
  • Unit Cell Volume: 203.5191734809996
  • Molar Volume: 10.213509250511992
  • Full Formula: Pr2 B2 Pt8
  • Reduced Formula: PrBPt4
  • Formula Anonymous: ABC4
  • Spacegroup Number: 191
  • Spacegroup Symbol: P6/mmm
  • Crystal System: hexagonal
  • Pointgroup: 6/mmm

Thermodynamics:

  • Final energy: -80.71043202
  • Final energy per atom: -6.725869335
  • 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.