Detail information of KMgP(H6O5)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	KMgP(H6O5)2
Full formula	K2Mg2P2H24O20
Tags	Magnesium potassium phosphate hexahydrate
Constituent elements	H; K; Mg; O; P;
Number of elements	5
Number of sites	50
Volume	479.51476 Å³
Density	1.84552 g/cm³
Source	Materials Project

Space group

Spacegroup Number	31
Hermann Mauguin	Pmn21
Hall	P 2ac -2
Crystal System	Orthorhombic

Lattice Parameters

a	6.955 Å	b	6.161 Å	c	11.191 Å
α	90.000°	β	90.000°	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
-269.62261 eV	-5.39245 eV	-1.82018 eV	4.75320 eV	0.00000 eV	0.00310 eV