Detail information of AlP3(HO5)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	AlP3(HO5)2
Full formula	Al4P12H8O40
Tags	Aluminium dihydrogentriphosphate(V) - II
Constituent elements	Al; H; O; P;
Number of elements	4
Number of sites	64
Volume	729.21689 Å³
Density	2.56783 g/cm³
Source	Materials Project

Space group

Spacegroup Number	14
Hermann Mauguin	P21/c
Hall	-P 2ybc
Crystal System	Monoclinic

Lattice Parameters

a	7.333 Å	b	8.625 Å	c	11.802 Å
α	90.000°	β	102.305°	γ	90.000°

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Style

Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-440.48792 eV	-6.88262 eV	-2.58416 eV	5.74050 eV	0.00015 eV	0.00231 eV