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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-767401
Created at: Sept. 4, 2022, 2:42 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 32
Number of elements: 3
Element list: ['Gd', 'As', 'O']
Chemical System: As-Gd-O
Density: 7.392604933302996
Atomic Density: 0.07587139922756529
Unit Cell Volume: 421.7663088566566
Molar Volume: 7.937300249251315
Full Formula: Gd8 As4 O20
Reduced Formula: Gd2AsO5
Formula Anonymous: AB2C5
Spacegroup Number: 85
Spacegroup Symbol: P4/n1
Crystal System: tetragonal
Pointgroup: 4/m

Thermodynamics:

Final energy: -329.51499287
Final energy per atom: -10.2973435271875
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.