Detail information of LiH20C8BrO4

Structure

Basic information

Pretty formulaLiH20C8BrO4
Full formulaLi2H40C16Br2O8
TagsBis(1,2-dimethoxyethane) lithium bromide
Constituent elementsBr; C; H; Li; O;
Number of elements5
Number of sites68
Volume670.42681 Å3
Density1.32306 g/cm3
Source Materials Project

Space group

Spacegroup Number15
Hermann MauguinC2/c
Hall-C 2yc
Crystal SystemMonoclinic

Lattice Parameters

a7.840 Å b7.840 Å c12.383 Å
α84.510° β95.490° γ117.569°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-356.46212 eV -5.24209 eV -0.56363 eV 4.64560 eV 0.00226 eV 0.16285 eV