Structure

Basic information

Pretty formulaCa2La8Ti5Cr5O30
Full formulaCa2La8Ti5Cr5O30
Tags
Constituent elementsCa; Cr; La; O; Ti;
Number of elements5
Number of sites50
Volume604.89106 Å3
Density5.95897 g/cm3
Source Materials Project

Space group

Spacegroup Number2
Hermann MauguinP-1
Hall-P 1
Crystal SystemTriclinic

Lattice Parameters

a5.522 Å b5.523 Å c27.620 Å
α60.677° β60.708° γ60.687°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-418.49390 eV -8.36988 eV -3.40949 eV 0.00000 eV 13.81244 eV 0.04041 eV