Detail information of V3P2H12C3N2O15

Structure

Basic information

Pretty formulaV3P2H12C3N2O15
Full formulaV12P8H48C12N8O60
TagsDiammoniumpropane (diphosphato(V)trivanadate) dihydrate
Constituent elementsC; H; N; O; P; V;
Number of elements6
Number of sites148
Volume1,532.28175 Å3
Density2.30137 g/cm3
Source Materials Project

Space group

Spacegroup Number62
Hermann MauguinPnma
Hall-P 2ac 2n
Crystal SystemOrthorhombic

Lattice Parameters

a10.668 Å b16.905 Å c8.497 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
-918.13713 eV -6.20363 eV -1.36702 eV 0.61690 eV 12.00074 eV 0.35672 eV