Detail information of KAlP2H4O9

Structure

Basic information

Pretty formulaKAlP2H4O9
Full formulaK8Al8P16H32O72
TagsPotassium aluminium bis(hydrogenphosphate(V)) hydrate;
Potassium aluminium bis(deuteriophosphate(V))
Constituent elementsAl; H; K; O; P;
Number of elements5
Number of sites136
Volume1,502.46185 Å3
Density2.44078 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.111 Å b9.208 Å c16.390 Å
α90.000° β100.061° γ90.000°

Note: if the model can't be displayed, try Firefox or Chrome.

Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-860.05376 eV -6.32393 eV -2.39949 eV 5.23670 eV 0.00000 eV 0.00992 eV