Detail information of V2PH10C2N2O8F

Structure

Basic information

Pretty formulaV2PH10C2N2O8F
Full formulaV8P4H40C8N8O32F4
TagsDiammoniumethane tecto-octaoxofluorodivanadophosphate(V);
Zeolite ULM-7V
Constituent elementsC; F; H; N; O; P; V;
Number of elements7
Number of sites104
Volume985.09448 Å3
Density2.30575 g/cm3
Source Materials Project

Space group

Spacegroup Number19
Hermann MauguinP212121
HallP 2ac 2ab
Crystal SystemOrthorhombic

Lattice Parameters

a8.410 Å b9.287 Å c12.613 Å
α90.000° β90.000° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-639.14681 eV -6.14564 eV -1.44424 eV 2.75610 eV 0.00006 eV 0.14973 eV