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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-680706
Created at: Sept. 4, 2022, 2:46 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 168
Number of elements: 3
Element list: ['Y', 'Sn', 'Pd']
Chemical System: Pd-Sn-Y
Density: 9.0855395097582
Atomic Density: 0.05054677945539956
Unit Cell Volume: 3323.653886757245
Molar Volume: 11.913994966412636
Full Formula: Y26 Sn62 Pd80
Reduced Formula: Y13Sn31Pd40
Formula Anonymous: A13B31C40
Spacegroup Number: 191
Spacegroup Symbol: P6/mmm
Crystal System: hexagonal
Pointgroup: 6/mmm

Thermodynamics:

Final energy: -959.45325004
Final energy per atom: -5.711031250238095
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.