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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-637582
Created at: Sept. 4, 2022, 2:45 p.m.
Last updated at: Nov. 28, 2021, 1:37 a.m.
Input Source: Materials Project

Structure:

Number of sites: 21
Number of elements: 5
Element list: ['Rb', 'Ba', 'Pt', 'C', 'N']
Chemical System: Ba-C-N-Pt-Rb
Density: 3.4643204209040444
Atomic Density: 0.048326684786142424
Unit Cell Volume: 434.54253261795657
Molar Volume: 12.461315703010598
Full Formula: Rb2 Ba1 Pt2 C8 N8
Reduced Formula: Rb2BaPt2(CN)8
Formula Anonymous: AB2C2D8E8
Spacegroup Number: 123
Spacegroup Symbol: P4/mmm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -163.65218092
Final energy per atom: -7.792960996190477
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.