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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-582201
Created at: Sept. 4, 2022, 2:48 p.m.
Last updated at: Nov. 28, 2021, 1:38 a.m.
Input Source: Materials Project

Structure:

Number of sites: 58
Number of elements: 2
Element list: ['Ge', 'Pd']
Chemical System: Ge-Pd
Density: 10.420758769161543
Atomic Density: 0.06462861454831705
Unit Cell Volume: 897.4352986731377
Molar Volume: 9.318071882072891
Full Formula: Ge16 Pd42
Reduced Formula: Ge8Pd21
Formula Anonymous: A8B21
Spacegroup Number: 88
Spacegroup Symbol: I4_1/a
Crystal System: tetragonal
Pointgroup: 4/m

Thermodynamics:

Final energy: -319.40475244
Final energy per atom: -5.506978490344827
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.