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  1. Third-Parties
  2. MatprojStructure
  3. mp-1096359

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-1096359
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 4
  • Number of elements: 3
  • Element list: ['Cd', 'Cu', 'Pt']
  • Chemical System: Cd-Cu-Pt
  • Density: 0.9041617529758949
  • Atomic Density: 0.0045050920034343505
  • Unit Cell Volume: 887.8841979144254
  • Molar Volume: 133.6740904605092
  • Full Formula: Cd2 Cu1 Pt1
  • Reduced Formula: Cd2CuPt
  • Formula Anonymous: ABC2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -6.47954205
  • Final energy per atom: -1.6198855125
  • 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.