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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-1104285
Created at: Sept. 4, 2022, 2:41 p.m.
Last updated at: Nov. 28, 2021, 1:35 a.m.
Input Source: Materials Project

Structure:

Number of sites: 14
Number of elements: 5
Element list: ['Rb', 'Ni', 'C', 'N', 'Cl']
Chemical System: C-Cl-N-Ni-Rb
Density: 2.6652797222075155
Atomic Density: 0.048502185462565746
Unit Cell Volume: 288.6467870773633
Molar Volume: 12.416225583583076
Full Formula: Rb2 Ni2 C4 N4 Cl2
Reduced Formula: RbNiC2N2Cl
Formula Anonymous: ABCD2E2
Spacegroup Number: 139
Spacegroup Symbol: I4/mmm
Crystal System: tetragonal
Pointgroup: 4/mmm

Thermodynamics:

Final energy: -94.29506724
Final energy per atom: -6.735361945714286
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.