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  1. Third-Parties
  2. MatprojStructure
  3. mp-11514

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-11514
  • 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: 3
  • Number of elements: 2
  • Element list: ['Nb', 'Pt']
  • Chemical System: Nb-Pt
  • Density: 16.497626434342827
  • Atomic Density: 0.061699212010276554
  • Unit Cell Volume: 48.62298726765462
  • Molar Volume: 9.760482449916797
  • Full Formula: Nb1 Pt2
  • Reduced Formula: NbPt2
  • Formula Anonymous: AB2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -24.30389271
  • Final energy per atom: -8.10129757
  • 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.