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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-1218685
Created at: Sept. 4, 2022, 2:43 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 32
Number of elements: 6
Element list: ['Sr', 'Ca', 'Y', 'Cu', 'Pb', 'O']
Chemical System: Ca-Cu-O-Pb-Sr-Y
Density: 6.896304532004917
Atomic Density: 0.06830921966683227
Unit Cell Volume: 468.4579937536263
Molar Volume: 8.815999932911057
Full Formula: Sr4 Ca1 Y1 Cu6 Pb4 O16
Reduced Formula: Sr4CaYCu6(PbO4)4
Formula Anonymous: ABC4D4E6F16
Spacegroup Number: 139
Spacegroup Symbol: I4/mmm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -197.45808768
Final energy per atom: -6.17056524
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.