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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220866

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-1220866
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 6
  • Number of elements: 3
  • Element list: ['Na', 'Sn', 'Pd']
  • Chemical System: Na-Pd-Sn
  • Density: 7.586663423405325
  • Atomic Density: 0.04729032715336616
  • Unit Cell Volume: 126.87584039208568
  • Molar Volume: 12.734402831407227
  • Full Formula: Na1 Sn2 Pd3
  • Reduced Formula: NaSn2Pd3
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 183
  • Spacegroup Symbol: P6mm
  • Crystal System: hexagonal
  • Pointgroup: 6mm

Thermodynamics:

  • Final energy: -27.7666274
  • Final energy per atom: -4.627771233333333
  • 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.