Structure

Basic information

Pretty formulaCa3La7Ti5Cr5O30
Full formulaCa6La14Ti10Cr10O60
Tags
Constituent elementsCa; Cr; La; O; Ti;
Number of elements5
Number of sites100
Volume1,216.77227 Å3
Density5.65500 g/cm3
Source Materials Project

Space group

Spacegroup Number6
Hermann MauguinPm
HallP -2y
Crystal SystemMonoclinic

Lattice Parameters

a5.564 Å b5.572 Å c39.251 Å
α90.000° β90.000° γ90.305°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-830.30976 eV -8.30310 eV -3.40126 eV 0.00000 eV 27.26839 eV 0.02732 eV