Structure

Basic information

Pretty formulaPr20AlSi19N33Cl2O19
Full formulaPr20Al1Si19N33Cl2O19
Tags
Constituent elementsAl; Cl; N; O; Pr; Si;
Number of elements6
Number of sites94
Volume1,405.22660 Å3
Density4.98185 g/cm3
Source Materials Project

Space group

Spacegroup Number6
Hermann MauguinPm
HallP -2y
Crystal SystemMonoclinic

Lattice Parameters

a10.631 Å b11.297 Å c11.701 Å
α90.000° β90.000° γ89.824°

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
-762.56549 eV -8.11240 eV -2.28507 eV 2.83900 eV -0.00089 eV 0.00000 eV