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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-570634
Created at: Sept. 4, 2022, 2:40 p.m.
Last updated at: Nov. 28, 2021, 1:35 a.m.
Input Source: Materials Project

Structure:

Number of sites: 80
Number of elements: 2
Element list: ['Cd', 'As']
Chemical System: As-Cd
Density: 5.978593408912383
Atomic Density: 0.036959238685569946
Unit Cell Volume: 2164.5467505594083
Molar Volume: 16.29400651683671
Full Formula: Cd48 As32
Reduced Formula: Cd3As2
Formula Anonymous: A2B3
Spacegroup Number: 142
Spacegroup Symbol: I4_1/acd
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -200.79160351
Final energy per atom: -2.509895043875
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.