Detail information of BaSi2(H3O4)2

Structure

Basic information

Pretty formulaBaSi2(H3O4)2
Full formulaBa4Si8H24O32
TagsBarium phyllo-disilicate trihydrate;
Krauskopfite
Constituent elementsBa; H; O; Si;
Number of elements4
Number of sites68
Volume725.81310 Å3
Density2.99744 g/cm3
Source Materials Project

Space group

Spacegroup Number14
Hermann MauguinP21/c
Hall-P 2ybc
Crystal SystemMonoclinic

Lattice Parameters

a7.930 Å b10.712 Å c8.574 Å
α90.000° β94.822° γ90.000°

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Style

Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-421.35813 eV -6.19644 eV -2.30928 eV 5.05790 eV -0.00028 eV 0.01592 eV