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  1. Third-Parties
  2. MatprojStructure
  3. mp-29639

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-29639
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 27
  • Number of elements: 2
  • Element list: ['Te', 'Pd']
  • Chemical System: Pd-Te
  • Density: 10.556742994134634
  • Atomic Density: 0.05680775721784478
  • Unit Cell Volume: 475.28720235268514
  • Molar Volume: 10.60091271849805
  • Full Formula: Te7 Pd20
  • Reduced Formula: Te7Pd20
  • Formula Anonymous: A7B20
  • Spacegroup Number: 148
  • Spacegroup Symbol: R-3H
  • Crystal System: trigonal
  • Pointgroup: -3

Thermodynamics:

  • Final energy: -133.5927891
  • Final energy per atom: -4.947881077777778
  • 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.