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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-706411
Created at: Sept. 4, 2022, 2:47 p.m.
Last updated at: Nov. 28, 2021, 1:38 a.m.
Input Source: Materials Project

Structure:

Number of sites: 148
Number of elements: 4
Element list: ['Fe', 'Sn', 'C', 'O']
Chemical System: C-Fe-O-Sn
Density: 2.0680646804794462
Atomic Density: 0.05831111694106223
Unit Cell Volume: 2538.1095023371017
Molar Volume: 10.327603167140252
Full Formula: Fe16 Sn4 C64 O64
Reduced Formula: Fe4Sn(CO)16
Formula Anonymous: AB4C16D16
Spacegroup Number: 14
Spacegroup Symbol: P12_1/c1
Crystal System: monoclinic
Pointgroup: 2/m

Thermodynamics:

Final energy: -1148.07355999
Final energy per atom: -7.757253783716216
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.