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  1. Third-Parties
  2. MatprojStructure
  3. mp-1221827

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-1221827
  • Created at: Sept. 4, 2022, 2:45 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Mn', 'Ni', 'Sn']
  • Chemical System: Mn-Ni-Sn
  • Density: 8.204397008718752
  • Atomic Density: 0.07626200975700059
  • Unit Cell Volume: 104.90151027347699
  • Molar Volume: 7.896645760043307
  • Full Formula: Mn3 Ni4 Sn1
  • Reduced Formula: Mn3Ni4Sn
  • Formula Anonymous: AB3C4
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m

Thermodynamics:

  • Final energy: -55.38756101
  • Final energy per atom: -6.92344512625
  • 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.