Detail information of Ti3V2O9

Structure

Basic information

Pretty formulaTi3V2O9
Full formulaTi6V4O18
TagsTrititanium divanadate;
Schreyerite
Constituent elementsO; Ti; V;
Number of elements3
Number of sites28
Volume375.60452 Å3
Density3.44375 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a10.870 Å b10.870 Å c6.942 Å
α75.612° β104.388° γ151.722°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-232.88211 eV -8.31722 eV -2.84686 eV 0.77830 eV 8.00000 eV 0.32009 eV