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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-637377
Created at: Sept. 4, 2022, 2:40 p.m.
Last updated at: Nov. 28, 2021, 1:34 a.m.
Input Source: Materials Project

Structure:

Number of sites: 14
Number of elements: 2
Element list: ['Ti', 'In']
Chemical System: In-Ti
Density: 5.9319464334842
Atomic Density: 0.037332361173826045
Unit Cell Volume: 375.0097652493379
Molar Volume: 16.131154233614783
Full Formula: Ti4 In10
Reduced Formula: Ti2In5
Formula Anonymous: A2B5
Spacegroup Number: 127
Spacegroup Symbol: P4/mbm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -58.60025679
Final energy per atom: -4.185732627857143
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.