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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-24559
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: 26
Number of elements: 5
Element list: ['Rb', 'Cu', 'H', 'Cl', 'O']
Chemical System: Cl-Cu-H-O-Rb
Density: 2.7883453772153244
Atomic Density: 0.05294220659142441
Unit Cell Volume: 491.1015553365977
Molar Volume: 11.374933437276617
Full Formula: Rb4 Cu2 H8 Cl8 O4
Reduced Formula: Rb2CuH4(Cl2O)2
Formula Anonymous: AB2C2D4E4
Spacegroup Number: 136
Spacegroup Symbol: P4_2/mnm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -112.22017968
Final energy per atom: -4.316160756923077
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.