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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-755251
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: 16
Number of elements: 3
Element list: ['Gd', 'Hf', 'O']
Chemical System: Gd-Hf-O
Density: 8.050971026671442
Atomic Density: 0.06769309711257282
Unit Cell Volume: 236.36087994898784
Molar Volume: 8.896240557564164
Full Formula: Gd4 Hf2 O10
Reduced Formula: Gd2HfO5
Formula Anonymous: AB2C5
Spacegroup Number: 15
Spacegroup Symbol: C12/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -188.35879747
Final energy per atom: -11.772424841875
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.