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  1. Third-Parties
  2. MatprojStructure
  3. mp-607853

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-607853
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 100
  • Number of elements: 3
  • Element list: ['Na', 'In', 'Au']
  • Chemical System: Au-In-Na
  • Density: 8.973211940871758
  • Atomic Density: 0.044447018225784465
  • Unit Cell Volume: 2249.8697098647735
  • Molar Volume: 13.549032084466027
  • Full Formula: Na32 In24 Au44
  • Reduced Formula: Na8In6Au11
  • Formula Anonymous: A6B8C11
  • Spacegroup Number: 57
  • Spacegroup Symbol: Pbcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -286.04051605
  • Final energy per atom: -2.8604051605
  • 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.