Detail information of NaH3(CO2)2 | Catalyst Database, First database in catalyst field

Structure

Basic information

Pretty formula	NaH3(CO2)2
Full formula	Na6H18C12O24
Tags	Sodium hydrogendiformate)
Constituent elements	C; H; Na; O;
Number of elements	4
Number of sites	60
Volume	735.07888 Å³
Density	1.54559 g/cm³
Source	Materials Project

Space group

Spacegroup Number	2
Hermann Mauguin	P-1
Hall	-P 1
Crystal System	Triclinic

Lattice Parameters

a	9.161 Å	b	9.432 Å	c	9.725 Å
α	83.236°	β	111.579°	γ	109.820°

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Calculated Energies

Total energy	Energy per atom	Formation energy per atom	Band gap	Total magnetization	Energy above hull
-364.16335 eV	-6.06939 eV	-1.42779 eV	4.63760 eV	0.00000 eV	0.12494 eV