Detail information of NdH32C8N4Cl7

Structure

Basic information

Pretty formulaNdH32C8N4Cl7
Full formulaNd2H64C16N8Cl14
TagsTetrakis(dimethylammonium) hexachloroneodymate(III) chloride
Constituent elementsC; Cl; H; N; Nd;
Number of elements5
Number of sites104
Volume1,273.74402 Å3
Density1.50386 g/cm3
Source Materials Project

Space group

Spacegroup Number18
Hermann MauguinP21212
HallP 2 2ab
Crystal SystemOrthorhombic

Lattice Parameters

a8.846 Å b10.572 Å c13.620 Å
α90.000° β90.000° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-516.92611 eV -4.97044 eV -0.68527 eV 4.72930 eV 0.00399 eV 0.04906 eV