Detail information of H4NF

Structure

Basic information

Pretty formulaH4NF
Full formulaH32N8F8
TagsTetradeuterioammonium fluoride - II
Constituent elementsF; H; N;
Number of elements3
Number of sites48
Volume348.03214 Å3
Density1.41369 g/cm3
Source Materials Project

Space group

Spacegroup Number161
Hermann MauguinR3c
HallR 3 -2"c
Crystal SystemHexagonal

Lattice Parameters

a7.384 Å b7.384 Å c7.384 Å
α70.840° β70.840° γ70.840°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-233.61962 eV -4.86708 eV -1.14508 eV 6.17960 eV -0.00022 eV 0.03177 eV