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  1. Third-Parties
  2. MatprojStructure
  3. mp-580525

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-580525
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 48
  • Number of elements: 3
  • Element list: ['Dy', 'Ni', 'Sn']
  • Chemical System: Dy-Ni-Sn
  • Density: 8.695353021769481
  • Atomic Density: 0.04567214117431654
  • Unit Cell Volume: 1050.9689006433646
  • Molar Volume: 13.185588862618326
  • Full Formula: Dy12 Ni12 Sn24
  • Reduced Formula: DyNiSn2
  • Formula Anonymous: ABC2
  • Spacegroup Number: 62
  • Spacegroup Symbol: Pnma
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -248.48382359
  • Final energy per atom: -5.176746324791666
  • 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.