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  1. Third-Parties
  2. MatprojStructure
  3. mp-1209130

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-1209130
  • 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: 20
  • Number of elements: 3
  • Element list: ['Sc', 'In', 'Pd']
  • Chemical System: In-Pd-Sc
  • Density: 7.1226840266414015
  • Atomic Density: 0.05136123750678556
  • Unit Cell Volume: 389.39871722050526
  • Molar Volume: 11.725069434326594
  • Full Formula: Sc8 In4 Pd8
  • Reduced Formula: Sc2InPd2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 136
  • Spacegroup Symbol: P4_2/mnm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm

Thermodynamics:

  • Final energy: -119.49350065000002
  • Final energy per atom: -5.9746750325
  • 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.