Detail information of K3NaP4(H2O7)2

Structure

Basic information

Pretty formulaK3NaP4(H2O7)2
Full formulaK6Na2P8H8O28
TagsTripotassium sodium dihydrogendiphosphate
Constituent elementsH; K; Na; O; P;
Number of elements5
Number of sites52
Volume714.99091 Å3
Density2.28625 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a9.434 Å b9.434 Å c11.354 Å
α80.914° β99.086° γ134.097°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-319.74782 eV -6.14900 eV -2.36228 eV 4.54050 eV 0.00000 eV 0.05130 eV