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  1. Third-Parties
  2. MatprojStructure
  3. mp-1001022

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-1001022
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Cu', 'P', 'Pd']
  • Chemical System: Cu-P-Pd
  • Density: 8.826699394699585
  • Atomic Density: 0.07165651179538314
  • Unit Cell Volume: 139.5546580407826
  • Molar Volume: 8.404177944352588
  • Full Formula: Cu4 P2 Pd4
  • Reduced Formula: Cu2PPd2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 37
  • Spacegroup Symbol: Ccc2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -50.71632482
  • Final energy per atom: -5.071632482
  • 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.