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  1. Third-Parties
  2. MatprojStructure
  3. mp-1192405

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-1192405
  • 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: 26
  • Number of elements: 4
  • Element list: ['Hg', 'P', 'Pd', 'O']
  • Chemical System: Hg-O-P-Pd
  • Density: 6.092160019467425
  • Atomic Density: 0.07904599734120965
  • Unit Cell Volume: 328.9224106790442
  • Molar Volume: 7.618527139337429
  • Full Formula: Hg2 P4 Pd4 O16
  • Reduced Formula: HgP2(PdO4)2
  • Formula Anonymous: AB2C2D8
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -167.85199251999998
  • Final energy per atom: -6.455845866153846
  • 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.