Detail information of CrP2H17N4O9

Structure

Basic information

Pretty formulaCrP2H17N4O9
Full formulaCr4P8H68N16O36
TagsTetraamminechromium hydrogen diphosphate(V) dihydrate
Constituent elementsCr; H; N; O; P;
Number of elements5
Number of sites132
Volume1,229.50393 Å3
Density1.78870 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a7.574 Å b13.894 Å c11.706 Å
α90.000° β93.564° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-756.99464 eV -5.73481 eV -1.38873 eV 3.98410 eV 12.00001 eV 0.03051 eV