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  1. Third-Parties
  2. MatprojStructure
  3. mp-11548

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-11548
  • 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: 9
  • Number of elements: 3
  • Element list: ['Yb', 'Tl', 'Pd']
  • Chemical System: Pd-Tl-Yb
  • Density: 11.57957213527392
  • Atomic Density: 0.04323743660186583
  • Unit Cell Volume: 208.1529504829993
  • Molar Volume: 13.928070749088132
  • Full Formula: Yb3 Tl3 Pd3
  • Reduced Formula: YbTlPd
  • Formula Anonymous: ABC
  • Spacegroup Number: 189
  • Spacegroup Symbol: P-62m
  • Crystal System: hexagonal
  • Pointgroup: -62m

Thermodynamics:

  • Final energy: -33.20982701
  • Final energy per atom: -3.6899807788888888
  • 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.