Structure

Basic information

Pretty formulaNa5CaAl5Fe(SiO3)12
Full formulaNa5Ca1Al5Fe1Si12O36
Tags
Constituent elementsAl; Ca; Fe; Na; O; Si;
Number of elements6
Number of sites60
Volume635.72706 Å3
Density3.28798 g/cm3
Source Materials Project

Space group

Spacegroup Number5
Hermann MauguinC2
HallC 2y
Crystal SystemMonoclinic

Lattice Parameters

a15.893 Å b6.487 Å c6.487 Å
α84.463° β77.321° γ77.321°

Note: if the model can't be displayed, try Firefox or Chrome.

Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-439.64910 eV -7.32749 eV -3.15195 eV 3.23450 eV 4.00019 eV 0.03433 eV