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  1. Third-Parties
  2. MatprojStructure
  3. mp-1218617

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-1218617
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 32
  • Number of elements: 6
  • Element list: ['Sr', 'Ca', 'Ho', 'Cu', 'Pb', 'O']
  • Chemical System: Ca-Cu-Ho-O-Pb-Sr
  • Density: 7.138213488991523
  • Atomic Density: 0.06804636213140851
  • Unit Cell Volume: 470.2676086960069
  • Molar Volume: 8.850055420112355
  • Full Formula: Sr4 Ca1 Ho1 Cu6 Pb4 O16
  • Reduced Formula: Sr4CaHoCu6(PbO4)4
  • Formula Anonymous: ABC4D4E6F16
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -195.91355102
  • Final energy per atom: -6.122298469375
  • 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.