Detail information of Mn2PH9(C4O3)3

Structure

Basic information

Pretty formulaMn2PH9(C4O3)3
Full formulaMn8P4H36C48O36
TagsTrimethylphosphinetetracarbonylmanganesepentacarbonyl- manganese
Constituent elementsC; H; Mn; O; P;
Number of elements5
Number of sites132
Volume1,802.32651 Å3
Density1.61434 g/cm3
Source Materials Project

Space group

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

Lattice Parameters

a8.759 Å b15.918 Å c13.175 Å
α90.000° β101.145° γ90.000°

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Calculated Energies

Total energyEnergy per atomFormation energy per atomBand gapTotal magnetizationEnergy above hull
-872.21324 eV -6.60768 eV -0.59784 eV 2.91040 eV 0.00015 eV 0.53691 eV