Structure

Basic information

Pretty formulaCa4Y2Al7Cr2SiO24
Full formulaCa8Y4Al14Cr4Si2O48
Tags
Constituent elementsAl; Ca; Cr; O; Si; Y;
Number of elements6
Number of sites80
Volume900.06886 Å3
Density3.84868 g/cm3
Source Materials Project

Space group

Spacegroup Number1
Hermann MauguinP1
HallP 1
Crystal SystemTriclinic

Lattice Parameters

a10.558 Å b10.515 Å c10.534 Å
α109.216° β109.749° γ109.464°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-601.38907 eV -7.51736 eV -3.28133 eV 0.50700 eV 6.00000 eV 0.04995 eV